-
1
-
-
19944367529
-
Introduction to Peptide Pharmaceuticals
-
D. J. Ward, Ed., Elsevier, New York
-
D. J. Ward, in Peptide Pharmaceuticals, D. J. Ward, Ed., Elsevier, New York, 1991, pp. 1-17. Introduction to Peptide Pharmaceuticals.
-
(1991)
Peptide Pharmaceuticals
, pp. 1-17
-
-
Ward, D.J.1
-
2
-
-
0001918583
-
Synthetic Chemistry and the Design of Peptide-Based Drugs
-
D. J. Ward, Ed., Elsevier, New York
-
V. J. Hruby, W. Kazmierski, A. M. Kawasaki, and T. O. Matsunaga, in Peptide Pharmaceuticals, D. J. Ward, Ed., Elsevier, New York, 1991, pp. 135-184. Synthetic Chemistry and the Design of Peptide-Based Drugs.
-
(1991)
Peptide Pharmaceuticals
, pp. 135-184
-
-
Hruby, V.J.1
Kazmierski, W.2
Kawasaki, A.M.3
Matsunaga, T.O.4
-
4
-
-
33745502124
-
Peptidomimetics for Receptor Ligands - Discovery, Development and Medicinal Perspectives
-
A. Giannis and T. Kolter, Angew. Chem. Int. Ed. Engl., 32, 1244 (1993). Peptidomimetics for Receptor Ligands - Discovery, Development and Medicinal Perspectives.
-
(1993)
Angew. Chem. Int. Ed. Engl.
, vol.32
, pp. 1244
-
-
Giannis, A.1
Kolter, T.2
-
5
-
-
0027478912
-
Peptidomimetics Derived from Natural Products
-
R. A. Wiley and D. H. Rich, Med. Res. Rev. 13, 327 (1993). Peptidomimetics Derived from Natural Products.
-
(1993)
Med. Res. Rev.
, vol.13
, pp. 327
-
-
Wiley, R.A.1
Rich, D.H.2
-
6
-
-
77957079236
-
Peptide Secondary Structure Mimetics: Recent Advances and Future Challenges
-
M. Kahn, Synlett, 11, 821 (1993). Peptide Secondary Structure Mimetics: Recent Advances and Future Challenges.
-
(1993)
Synlett
, vol.11
, pp. 821
-
-
Kahn, M.1
-
7
-
-
0027423502
-
Concepts and Progress in the Development of Peptide Mimetics
-
G. L. Olson, D. R. Bolin, M. P. Bonner, M. Bös, C. M. Cook, D. C. Fry, B. J. Graves, M. Hatada, D. E. Hill, M. Kahn, V. S. Madison, V. K. Rusiecki, R. Sarabu, J. Sepinwall, G. P. Vincent, and M. E. Voss, J. Med. Chem., 36, 3039 (1993). Concepts and Progress in the Development of Peptide Mimetics.
-
(1993)
J. Med. Chem.
, vol.36
, pp. 3039
-
-
Olson, G.L.1
Bolin, D.R.2
Bonner, M.P.3
Bös, M.4
Cook, C.M.5
Fry, D.C.6
Graves, B.J.7
Hatada, M.8
Hill, D.E.9
Kahn, M.10
Madison, V.S.11
Rusiecki, V.K.12
Sarabu, R.13
Sepinwall, J.14
Vincent, G.P.15
Voss, M.E.16
-
8
-
-
0013534646
-
Conformationally Restricted Amino Acids and Dipeptides (Non)Peptidomimetics and Secondary Structure Mimetics
-
R. M. J. Liskamp, Recl. Trav. Chim. Pays-Bas, 113, 1 (1994). Conformationally Restricted Amino Acids and Dipeptides (Non)Peptidomimetics and Secondary Structure Mimetics.
-
(1994)
Recl. Trav. Chim. Pays-Bas
, vol.113
, pp. 1
-
-
Liskamp, R.M.J.1
-
9
-
-
0005449318
-
Case Histories of Peptidomimetics: Progress from Peptides to Drugs
-
A. E. P. Adang, P. H. H. Hermkens, J. T. M. Linders, H. C. J. Ottenheijm, and C. J. van Staveren, Recl. Trav. Chim. Pays-Bas, 113, 63 (1994). Case Histories of Peptidomimetics: Progress from Peptides to Drugs.
-
(1994)
Recl. Trav. Chim. Pays-Bas
, vol.113
, pp. 63
-
-
Adang, A.E.P.1
Hermkens, P.H.H.2
Linders, J.T.M.3
Ottenheijm, H.C.J.4
Van Staveren, C.J.5
-
10
-
-
0028038601
-
Peptidomimetics - Tailored Enzyme Inhibitors
-
J. Gante, Angew. Chem. Int. Ed. Engl., 33, 1699 (1994). Peptidomimetics - Tailored Enzyme Inhibitors.
-
(1994)
Angew. Chem. Int. Ed. Engl.
, vol.33
, pp. 1699
-
-
Gante, J.1
-
12
-
-
0000545418
-
Peptidomimetics for Drug Design
-
M. E. Wolff, Ed., Wiley, New York
-
M. Goodman and S. Ro, in Burger's Medicinal Chemistry and Drug Discovery, 5th ed., M. E. Wolff, Ed., Wiley, New York. 1995, Vol. 1, pp. 803-861. Peptidomimetics for Drug Design.
-
(1995)
Burger's Medicinal Chemistry and Drug Discovery, 5th Ed.
, vol.1
, pp. 803-861
-
-
Goodman, M.1
Ro, S.2
-
13
-
-
0000219483
-
Peptide Secondary Structure Mimetics
-
M. Kahn, Ed., Tetrahedron Symposiwn-in-Print 50, 49, pp. 3433 ff. (1993). Peptide Secondary Structure Mimetics.
-
(1993)
Tetrahedron Symposiwn-in-Print 50
, vol.49
-
-
Kahn, M.1
-
14
-
-
85068946418
-
-
U.S. Patent 5,331,573 (1994). Method of Design of Compounds That Mimic Conformational Features of Selected Peptides
-
V. N. Balaji and U. C. Singh, U.S. Patent 5,331,573 (1994). Method of Design of Compounds That Mimic Conformational Features of Selected Peptides.
-
-
-
Balaji, V.N.1
Singh, U.C.2
-
15
-
-
0001016942
-
Structure-Based Molecular Design
-
I. D. Kuntz, E. C. Meng, and B. K. Shoichet, Acc. Chem. Res., 27, 117 (1994). Structure-Based Molecular Design.
-
(1994)
Acc. Chem. Res.
, vol.27
, pp. 117
-
-
Kuntz, I.D.1
Meng, E.C.2
Shoichet, B.K.3
-
16
-
-
0027193713
-
GroupBuild: A Fragment-Based Method for de Novo Drug Design
-
S. H. Rotstein and M. A. Murcko, J. Med. Chem., 36, 1700 (1993). GroupBuild: A Fragment-Based Method for De Novo Drug Design.
-
(1993)
J. Med. Chem.
, vol.36
, pp. 1700
-
-
Rotstein, S.H.1
Murcko, M.A.2
-
17
-
-
0024380931
-
Cholecystokinin Antagonists. Synthesis and Biological Evaluation of 3-Substituted Benzolactams
-
See, for example, W. H. Parsons, A. A. Patchett, M. K. Holloway, G. M. Smith, J. L. Davison, V. J. Lotti, and R. S. L. Chang, J. Med. Chem., 32, 1681 (1989). Cholecystokinin Antagonists. Synthesis and Biological Evaluation of 3-Substituted Benzolactams. See also references therein.
-
(1989)
J. Med. Chem.
, vol.32
, pp. 1681
-
-
Parsons, W.H.1
Patchett, A.A.2
Holloway, M.K.3
Smith, G.M.4
Davison, J.L.5
Lotti, V.J.6
Chang, R.S.L.7
-
18
-
-
0026576626
-
Hybrid Cholecystokinin-A Antagonist Based on Molecular Modeling of Lorglumide and L-364,718
-
See, for example, A. van der Bent, A. G. S. Blommaert, C. T. M. Melman, A. P. Ijzerman, I. van Wijngaarden, and W. Soudijn, J. Med. Chem., 35, 1042 (1992). Hybrid Cholecystokinin-A Antagonist Based on Molecular Modeling of Lorglumide and L-364,718.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 1042
-
-
Van Der Bent, A.1
Blommaert, A.G.S.2
Melman, C.T.M.3
Ijzerman, A.P.4
Van Wijngaarden, I.5
Soudijn, W.6
-
19
-
-
0002649780
-
Design and Discovery in the Development of Peptide Analogs
-
J. A. Smith and J. E. Rivier, Eds., ESCOM, Leiden
-
D. F. Veber, in Peptides: Proceedings of the Twelfth American Peptide Symposium, J. A. Smith and J. E. Rivier, Eds., ESCOM, Leiden, 1992, pp. 3-14. Design and Discovery in the Development of Peptide Analogs.
-
(1992)
Peptides: Proceedings of the Twelfth American Peptide Symposium
, pp. 3-14
-
-
Veber, D.F.1
-
20
-
-
0027196532
-
NMR Structure of a Receptor-Bound G-Protein Peptide
-
See, for example, E. A. Dratz, J. E. Furstenau, C. G. Lambert, D. L. Thireault, H. Rarick, T. Schepers, S. Pakhlevaniants, and H. E. Hamm, Nature, 363, 276 (1993). NMR Structure of a Receptor-Bound G-Protein Peptide.
-
(1993)
Nature
, vol.363
, pp. 276
-
-
Dratz, E.A.1
Furstenau, J.E.2
Lambert, C.G.3
Thireault, D.L.4
Rarick, H.5
Schepers, T.6
Pakhlevaniants, S.7
Hamm, H.E.8
-
21
-
-
0028186402
-
Inhibitors of Human Leukocyte Elastase
-
P. R. Bernstein, P. D. Edwards, and J. C. Williams, Progr. Med. Chem., 31, 59 (1994). Inhibitors of Human Leukocyte Elastase.
-
(1994)
Progr. Med. Chem.
, vol.31
, pp. 59
-
-
Bernstein, P.R.1
Edwards, P.D.2
Williams, J.C.3
-
24
-
-
0028245052
-
Design of Orally Active, Non-Peptidic Inhibitors of Human Leukocyte Elastase
-
F. J. Brown, D. W. Andisik, P. R. Bernstein, C. B. Bryant, C. Ceccarelli, J. R. Damewood, Jr., P. D. Edwards, R. A. Earley, S. Feeney, R. C. Green, B. Gomes, B. J. Kosmider, R. D. Krell, A. Shaw, G. B. Steelman, R. M. Thomas, E. P. Vacek, C. A. Veale, P. A. Tuthill, P. Warner, J. C. Williams, D. J. Wolanin, and S. A. Woolson, J. Med. Chem., 37, 1259 (1994). Design of Orally Active, Non-Peptidic Inhibitors of Human Leukocyte Elastase.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 1259
-
-
Brown, F.J.1
Andisik, D.W.2
Bernstein, P.R.3
Bryant, C.B.4
Ceccarelli, C.5
Damewood Jr., J.R.6
Edwards, P.D.7
Earley, R.A.8
Feeney, S.9
Green, R.C.10
Gomes, B.11
Kosmider, B.J.12
Krell, R.D.13
Shaw, A.14
Steelman, G.B.15
Thomas, R.M.16
Vacek, E.P.17
Veale, C.A.18
Tuthill, P.A.19
Warner, P.20
Williams, J.C.21
Wolanin, D.J.22
Woolson, S.A.23
more..
-
25
-
-
0027996496
-
Non-Peptidic Inhibitors of Human Leukocyte Elastase. 1. The Design and Synthesis of Pyridone-Containing Inhibitors
-
P. Warner, R. C. Green, B. Gomes, and A. M. Strimpler, J. Med. Chem., 37, 3090 (1994). Non-Peptidic Inhibitors of Human Leukocyte Elastase. 1. The Design and Synthesis of Pyridone-Containing Inhibitors.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 3090
-
-
Warner, P.1
Green, R.C.2
Gomes, B.3
Strimpler, A.M.4
-
26
-
-
0027942444
-
Nonpeptidic Inhibitors of Human Leukocyte Elastase. 2. Design, Synthesis, and in Vitro Activity of a Series of 3-Amino-6-Arylopyridin-2-one Trifluoromethyl Ketones
-
J. R. Damewood, Jr., P. D. Edwards, S. Feeney, B. C. Gomes, G. B. Steelman, P. A. Tuthill, J. C. Williams, P. Warner, S. A. Woolson, D. J. Wolanin, and C. A. Veale, J. Med. Chem., 37, 3303 (1994). Nonpeptidic Inhibitors of Human Leukocyte Elastase. 2. Design, Synthesis, and In Vitro Activity of a Series of 3-Amino-6-Arylopyridin-2-one Trifluoromethyl Ketones.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 3303
-
-
Damewood Jr., J.R.1
Edwards, P.D.2
Feeney, S.3
Gomes, B.C.4
Steelman, G.B.5
Tuthill, P.A.6
Williams, J.C.7
Warner, P.8
Woolson, S.A.9
Wolanin, D.J.10
Veale, C.A.11
-
27
-
-
0027945808
-
Nonpeptidic Inhibitors of Human Leukocyte Elastase. 3. Design, Synthesis, X-Ray Crystallographic Analysis, and Structure - Activity Relationship for a Series of Orally Active 3-Amino-6-Phenylpyridin-2-ones
-
P. R. Bernstein, D. Andisik, P. Bradley, C. B. Bryant, C. Ceccarelli, J. R. Damewood, Jr., R. Earley, S. Feeney, B. C. Gomes, B. J. Kosmider, G. B. Steelman, R. M. Thomas, E. P. Vacek, C. A. Veale, J. C. Williams, D. J. Wolanin, and S. A. Woolson, J. Med. Chem., 37, 3313 (1994). Nonpeptidic Inhibitors of Human Leukocyte Elastase. 3. Design, Synthesis, X-Ray Crystallographic Analysis, and Structure - Activity Relationship for a Series of Orally Active 3-Amino-6-Phenylpyridin-2-ones.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 3313
-
-
Bernstein, P.R.1
Andisik, D.2
Bradley, P.3
Bryant, C.B.4
Ceccarelli, C.5
Damewood Jr., J.R.6
Earley, R.7
Feeney, S.8
Gomes, B.C.9
Kosmider, B.J.10
Steelman, G.B.11
Thomas, R.M.12
Vacek, E.P.13
Veale, C.A.14
Williams, J.C.15
Wolanin, D.J.16
Woolson, S.A.17
-
28
-
-
0029008367
-
Non-Peptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of a Series of Orally Active 5-Aminopyrimidin-6-one-Containing Trifluoromethyl Ketones
-
C. A. Veale, P. R. Bernstein, C. B. Bryant, C. Ceccarelli, J. R. Damewood, Jr., R. Earley, S. Feeney, B. C. Gomes, B. J. Kosmider, G. B. Steelman, R. M. Thomas, E. P. Vacek, J. C. Williams, D. J. Wolanin, and S. A. Woolson, J. Med. Chem., 38, 98 (1995). Non-Peptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of a Series of Orally Active 5-Aminopyrimidin-6-one-Containing Trifluoromethyl Ketones.
-
(1995)
J. Med. Chem.
, vol.38
, pp. 98
-
-
Veale, C.A.1
Bernstein, P.R.2
Bryant, C.B.3
Ceccarelli, C.4
Damewood Jr., J.R.5
Earley, R.6
Feeney, S.7
Gomes, B.C.8
Kosmider, B.J.9
Steelman, G.B.10
Thomas, R.M.11
Vacek, E.P.12
Williams, J.C.13
Wolanin, D.J.14
Woolson, S.A.15
-
29
-
-
0022801412
-
Crystal Structure of the Complex of Human Leukocyte Elastase (PMN Elastase) and the Third Domain of the Turkey Ovomucoid Inhibitor
-
W. Bode, A.-Z. Wie, R. Huber, E. Meyer, J. Travis, and S. Neumann, EMBO J., 5, 2453 (1986). Crystal Structure of the Complex of Human Leukocyte Elastase (PMN Elastase) and the Third Domain of the Turkey Ovomucoid Inhibitor.
-
(1986)
EMBO J.
, vol.5
, pp. 2453
-
-
Bode, W.1
Wie, A.-Z.2
Huber, R.3
Meyer, E.4
Travis, J.5
Neumann, S.6
-
30
-
-
0023875174
-
X-Ray Diffraction Analysis of the Inhibition of Porcine Pancreatic Elastase by a Peptidyl Trifluoromethylketone
-
L. H. Takahashi, R. Radhakrishnan, R. E. Rosenfield Jr., E. F. Meyer Jr., D. A. Trainor, and M. Stein, J. Mol. Biol., 201, 423 (1988). X-Ray Diffraction Analysis of the Inhibition of Porcine Pancreatic Elastase by a Peptidyl Trifluoromethylketone.
-
(1988)
J. Mol. Biol.
, vol.201
, pp. 423
-
-
Takahashi, L.H.1
Radhakrishnan, R.2
Rosenfield Jr., R.E.3
Meyer Jr., E.F.4
Trainor, D.A.5
Stein, M.6
-
31
-
-
0014211618
-
On the Size of the Active Site in Proteases. I. Papain
-
The nomenclature system of Schechter and Berger for residues on either side of the scissile bond is used throughout this chapter. I. Schechter and A. Berger, Biochem. Biophys. Res. Commun., 27, 157 (1967). On the Size of the Active Site in Proteases. I. Papain.
-
(1967)
Biochem. Biophys. Res. Commun.
, vol.27
, pp. 157
-
-
Schechter, I.1
Berger, A.2
-
32
-
-
0343405849
-
-
AESOP is an in-house molecular mechanics program at Zeneca, Inc., Wilmington, DE 19897, derived in part from BIGSTRN-3 (QCPE 514): R. B. Nachbar, Jr., and K. Mislow, QCPE Bull., 6, 96 (1986).
-
(1986)
QCPE Bull.
, vol.6
, pp. 96
-
-
Nachbar Jr., R.B.1
Mislow, K.2
-
34
-
-
0003525155
-
-
Wiley, New York
-
C. L. Brooks III, M. Karplus, and B. M. Pettitt, Proteins. A Theoretical Perspective of Dynamics, Structure and Thermodynamics, Wiley, New York, 1988.
-
(1988)
Proteins. A Theoretical Perspective of Dynamics, Structure and Thermodynamics
-
-
Brooks III, C.L.1
Karplus, M.2
Pettitt, B.M.3
-
36
-
-
84862582328
-
Computer Simulation of Biomolecular Systems using Molecular Dynamics and Free Energy Perturbation Methods
-
K. B. Lipkowitz and D. B. Boyd, Eds., VCH Publishers, New York
-
T. P. Lybrand, in Reviews in Computational Chemistry, K. B. Lipkowitz and D. B. Boyd, Eds., VCH Publishers, New York, 1990, Vol. 1, pp. 295-320. Computer Simulation of Biomolecular Systems using Molecular Dynamics and Free Energy Perturbation Methods.
-
(1990)
Reviews in Computational Chemistry
, vol.1
, pp. 295-320
-
-
Lybrand, T.P.1
-
37
-
-
85068951603
-
-
U. C. Singh, P. Weiner, J. C. Caldwell, and P. A. Kollman, AMBER, University of California, San Francisco, 1989
-
U. C. Singh, P. Weiner, J. C. Caldwell, and P. A. Kollman, AMBER, University of California, San Francisco, 1989.
-
-
-
-
38
-
-
0029040711
-
Non-Peptidic Inhibitors of Human Leukocyte Elastase. 4. Design, Synthesis, and in Vitro and in Vivo Activity of a Series of β-Carbolinone-Containing Trifluoromethyl Ketones
-
C. A. Veale, J. R. Damewood, Jr., G. B. Steelman, C. Bryant, B. Gomes, and J. Williams, J. Med. Chem., 38, 86 (1995). Non-Peptidic Inhibitors of Human Leukocyte Elastase. 4. Design, Synthesis, and In Vitro and In Vivo Activity of a Series of β-Carbolinone-Containing Trifluoromethyl Ketones.
-
(1995)
J. Med. Chem.
, vol.38
, pp. 86
-
-
Veale, C.A.1
Damewood Jr., J.R.2
Steelman, G.B.3
Bryant, C.4
Gomes, B.5
Williams, J.6
-
39
-
-
0030009748
-
Nonpeptidic Inhibitors of Human Neutrophil Elastase. 7. Design, Synthesis, and in Vitro Activity of a Series of Pyridopyrimidine-Containing Trifluoromethyl Ketones
-
P. D. Edwards, D. W. Andisik, A. M. Strimpler, B. Gomes, and P. A. Tuthill, J. Med. Chem., 39, 1112 (1996). Nonpeptidic Inhibitors of Human Neutrophil Elastase. 7. Design, Synthesis, and in Vitro Activity of a Series of Pyridopyrimidine-Containing Trifluoromethyl Ketones.
-
(1996)
J. Med. Chem.
, vol.39
, pp. 1112
-
-
Edwards, P.D.1
Andisik, D.W.2
Strimpler, A.M.3
Gomes, B.4
Tuthill, P.A.5
-
40
-
-
7044239742
-
Free Energy Calculations: Applications to Chemical and Biochemical Phenomena
-
P. Kollman, Cheat. Rev., 93, 2395 (1993). Free Energy Calculations: Applications to Chemical and Biochemical Phenomena.
-
(1993)
Cheat. Rev.
, vol.93
, pp. 2395
-
-
Kollman, P.1
-
41
-
-
19944425430
-
-
Pharmaco Chemistry Library, Elsevier, New York
-
P. B. M. W. M. Timmermans and R. R. Wexler, Eds., Medicinal Chemistry of the Renin-Angiotensin System, Pharmaco Chemistry Library, 21, Elsevier, New York, 1994.
-
(1994)
Medicinal Chemistry of the Renin-Angiotensin System
, vol.21
-
-
Timmermans, P.B.M.W.M.1
Wexler, R.R.2
-
42
-
-
0000125456
-
Peptidase Inhibitors
-
P. G. Sammes, Ed., Pergamon Press, New York
-
D. H. Rich, in Comprehensive Medicinal Chemistry. The Rational Design, Mechanistic Study & Therapeutic Application of Chemical Compounds, Enzymes and Other Molecular Targets, P. G. Sammes, Ed., Pergamon Press, New York, 1990, Vol. 2, pp. 414 ff. Peptidase Inhibitors.
-
(1990)
Comprehensive Medicinal Chemistry. The Rational Design, Mechanistic Study & Therapeutic Application of Chemical Compounds, Enzymes and Other Molecular Targets
, vol.2
-
-
Rich, D.H.1
-
43
-
-
0026683982
-
X-Ray Analysis of Peptide Inhibitor Complexes Define the Structural Basis of Specificity for Human and Mouse Renins
-
V. Dhanaraj, C. Dealwis, C. Frazao, M. Badasso, B. L. Sibanda, I. J. Tickle, J. B. Cooper, H. P. C. Driessen, M. Newman, C. Aguilar, S. P. Wood, T. L. Blundell, P. M. Hobart, K. F. Geoghegan, M. J. Ammirati, D. E. Danley, B. A. O'Connor, and D. J. Hoover, Nature, 357, 466 (1992). X-Ray Analysis of Peptide Inhibitor Complexes Define the Structural Basis of Specificity for Human and Mouse Renins.
-
(1992)
Nature
, vol.357
, pp. 466
-
-
Dhanaraj, V.1
Dealwis, C.2
Frazao, C.3
Badasso, M.4
Sibanda, B.L.5
Tickle, I.J.6
Cooper, J.B.7
Driessen, H.P.C.8
Newman, M.9
Aguilar, C.10
Wood, S.P.11
Blundell, T.L.12
Hobart, P.M.13
Geoghegan, K.F.14
Ammirati, M.J.15
Danley, D.E.16
O'Connor, B.A.17
Hoover, D.J.18
-
44
-
-
0026354245
-
Comparative Modeling of Proteins in the Design of Novel Renin Inhibitors
-
C. Hutchins and J. Greer, Crit. Rev. Biochem. Mol. Biol., 26, 77 (1991). Comparative Modeling of Proteins in the Design of Novel Renin Inhibitors.
-
(1991)
Crit. Rev. Biochem. Mol. Biol.
, vol.26
, pp. 77
-
-
Hutchins, C.1
Greer, J.2
-
45
-
-
0343140960
-
Renin-Inhibitoren-von 'Transition-State' Analogen und Peptidmimetika zu blutdrucksenkenden Wirkstoffen
-
B. Weidmann, Chimia, 45, 367 (1991). Renin-Inhibitoren-von 'Transition-State' Analogen und Peptidmimetika zu blutdrucksenkenden Wirkstoffen.
-
(1991)
Chimia
, vol.45
, pp. 367
-
-
Weidmann, B.1
-
46
-
-
0026318948
-
2′ Sites
-
B. M. Dunn, Ed., Plenum Press, New York
-
2′ Sites.
-
(1991)
Structure and Function of the Aspartic Proteinases
, pp. 325-334
-
-
Williams, P.D.1
Payne, L.S.2
Perlow, D.S.3
Holloway, M.K.4
Siegl, P.K.S.5
Schorn, T.W.6
Lynch, R.J.7
Doyle, J.J.8
Strouse, J.F.9
Vlasuk, G.P.10
Hoogsteen, K.11
Springer, J.P.12
Bush, B.L.13
Halgren, T.A.14
TenBroeke, J.15
Greenlee, W.J.16
Richards, A.D.17
Kay, J.18
Veber, D.F.19
-
47
-
-
19944405022
-
Renin Inhibitor Design Through Molecular Modeling
-
Pharmaco Chemistry Library, P. B. M. W. M. Timmermans and R. R. Wexler, Eds., Elsevier, New York
-
E. A. Lunney and C. Humblet, in Medicinal Chemistry of the Renin-Angiotensin System, Pharmaco Chemistry Library, 21, P. B. M. W. M. Timmermans and R. R. Wexler, Eds., Elsevier, New York, 1994, pp. 73-101. Renin Inhibitor Design Through Molecular Modeling.
-
(1994)
Medicinal Chemistry of the Renin-Angiotensin System
, vol.21
, pp. 73-101
-
-
Lunney, E.A.1
Humblet, C.2
-
48
-
-
0027081659
-
Design, Synthesis, and Crystal Structure of a Pyrrolinone-Based Peptidomimetic Possessing the Conformation of a β-Strand: Potential Application to the Design of Novel Inhibitors of Proteolytic Enzymes
-
A. B. Smith III, T. P. Keenan, R. C. Holcomb, P. A. Sprengeler, M. C. Guzman, J. L. Wood, P. J. Carroll, and R. Hirschmann, J. Am. Chem. Soc., 114, 10672 (1992). Design, Synthesis, and Crystal Structure of a Pyrrolinone-Based Peptidomimetic Possessing the Conformation of a β-Strand: Potential Application to the Design of Novel Inhibitors of Proteolytic Enzymes.
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 10672
-
-
Smith III, A.B.1
Keenan, T.P.2
Holcomb, R.C.3
Sprengeler, P.A.4
Guzman, M.C.5
Wood, J.L.6
Carroll, P.J.7
Hirschmann, R.8
-
49
-
-
0027987391
-
De Novo Design, Synthesis and X-Ray Crystal Structures of Pyrrolinone-Based β-Strand Peptidomimetics
-
A. B. Smith III, M. C. Guzman, P. A. Sprengeler, T. P. Keenan, R. C. Holcomb, J. L. Wood, P. J. Carroll, and R. Hirschmann, J. Am. Chem. Soc., 116, 9947 (1994). De Novo Design, Synthesis and X-Ray Crystal Structures of Pyrrolinone-Based β-Strand Peptidomimetics.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 9947
-
-
Smith III, A.B.1
Guzman, M.C.2
Sprengeler, P.A.3
Keenan, T.P.4
Holcomb, R.C.5
Wood, J.L.6
Carroll, P.J.7
Hirschmann, R.8
-
50
-
-
0028031720
-
Design and Synthesis of Peptidomimetic Inhibitors of HIV-1 Protease and Renin. Evidence for Improved Transport
-
A. B. Smith III, R. Hirschmann, A. Pasternak, R. Akaishi, M. C. Guzman, D. R. Jones, T. P. Keenan, P. A. Sprengeler, P. L. Drake, E. A. Emini, M. K. Holloway, and W. A. Schleif, J. Med. Chem., 37, 215 (1994). Design and Synthesis of Peptidomimetic Inhibitors of HIV-1 Protease and Renin. Evidence for Improved Transport.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 215
-
-
Smith III, A.B.1
Hirschmann, R.2
Pasternak, A.3
Akaishi, R.4
Guzman, M.C.5
Jones, D.R.6
Keenan, T.P.7
Sprengeler, P.A.8
Drake, P.L.9
Emini, E.A.10
Holloway, M.K.11
Schleif, W.A.12
-
51
-
-
0028941674
-
Design and Synthesis of Nonpeptide Peptidomimetic Inhibitors of Renin
-
The reader is referred to continuing work, published after the time period covered by this review, from the following paper: A. B. Smith III, R. Akaishi, D. R. Jones, T. P. Keenan, M. C. Guzman, R. C. Holcomb, P. A. Sprengeler, J. L. Wood, R. Hirschmann, and M. K. Holloway, Biopolymers, 37, 29 (1995). Design and Synthesis of Nonpeptide Peptidomimetic Inhibitors of Renin.
-
(1995)
Biopolymers
, vol.37
, pp. 29
-
-
Smith III, A.B.1
Akaishi, R.2
Jones, D.R.3
Keenan, T.P.4
Guzman, M.C.5
Holcomb, R.C.6
Sprengeler, P.A.7
Wood, J.L.8
Hirschmann, R.9
Holloway, M.K.10
-
52
-
-
0024273613
-
Renin Inhibitors. Dipeptide Analogues of Angiotensinogen Utilizing a Dihydroxyethylene Transition-State Mimic at the Scissile Bond to Impart Greater Inhibitory Potency
-
J. R. Luly, N. BaMaung, J. Soderquist, A. K. L. Fung, H. Stein, H. D. Kleinert, P. A. Marcotte, D. A. Egan, B. Bopp, I. Merits, G. Bolis, J. Greer, T. J. Perun, and J. J. Plattner, J. Med. Chem., 31, 2264 (1988). Renin Inhibitors. Dipeptide Analogues of Angiotensinogen Utilizing a Dihydroxyethylene Transition-State Mimic at the Scissile Bond to Impart Greater Inhibitory Potency.
-
(1988)
J. Med. Chem.
, vol.31
, pp. 2264
-
-
Luly, J.R.1
Bamaung, N.2
Soderquist, J.3
Fung, A.K.L.4
Stein, H.5
Kleinert, H.D.6
Marcotte, P.A.7
Egan, D.A.8
Bopp, B.9
Merits, I.10
Bolis, G.11
Greer, J.12
Perun, T.J.13
Plattner, J.J.14
-
53
-
-
0023910548
-
New Human Renin Inhibitors Containing an Unnatural Amino Acid, Norstatine
-
K. Izuka, T. Kamijo, T. Kubota, K. Akahane, H. Umeyama, and Y. Kiso. J. Med. Chem., 31, 701 (1988). New Human Renin Inhibitors Containing an Unnatural Amino Acid, Norstatine.
-
(1988)
J. Med. Chem.
, vol.31
, pp. 701
-
-
Izuka, K.1
Kamijo, T.2
Kubota, T.3
Akahane, K.4
Umeyama, H.5
Kiso, Y.6
-
54
-
-
84986437005
-
MacroModel - An Integrated Software System for Modeling Organic and Bioorganic Molecules Using Molecular Mechanics
-
F. Mohamadi, N. G. J. Richards, W. C. Guida, R. Liskamp, M. Lipton, C. Caufield, G. Chang, T. Hendrickson, and W. C. Still, J. Comput. Chem., 11, 440 (1990). MacroModel - An Integrated Software System for Modeling Organic and Bioorganic Molecules Using Molecular Mechanics.
-
(1990)
J. Comput. Chem.
, vol.11
, pp. 440
-
-
Mohamadi, F.1
Richards, N.G.J.2
Guida, W.C.3
Liskamp, R.4
Lipton, M.5
Caufield, C.6
Chang, G.7
Hendrickson, T.8
Still, W.C.9
-
55
-
-
0025753968
-
1′ Dipeptide Mimetics
-
1′ Dipeptide Mimetics.
-
(1991)
J. Med. Chem.
, vol.34
, pp. 887
-
-
Williams, P.D.1
Perlow, D.S.2
Payne, L.S.3
Holloway, M.K.4
Siegl, P.K.S.5
Schorn, T.W.6
Lynch, R.J.7
Doyle, J.J.8
Strousse, J.F.9
Vlasuk, G.P.10
Hoogsteen, K.11
Springer, J.P.12
Bush, B.L.13
Halgren, T.A.14
Richards, A.D.15
Kay, J.16
Veber, D.F.17
-
56
-
-
0000125456
-
Peptidase Inhibitors
-
P. G. Sammes, Ed., Pergamon Press, New York
-
D. H. Rich, in Comprehensive Medicinal Chemistry. The Rational Design, Mechanistic Study & Therapeutic Application of Chemical Compounds, Enzymes and Other Molecular Targets, P. G. Sammes, Ed., Pergamon Press, New York, 1990, Vol. 2, pp. 400 ff. Peptidase Inhibitors.
-
(1990)
Comprehensive Medicinal Chemistry. The Rational Design, Mechanistic Study & Therapeutic Application of Chemical Compounds, Enzymes and Other Molecular Targets
, vol.2
-
-
Rich, D.H.1
-
57
-
-
33845283120
-
An Acyl-Iminium Ion Cyclization Route to a Novel Conformationally Restricted Dipeptide Mimic: Applications to Angiotensin-Converting Enzyme Inhibition
-
G. A. Flynn, E. L. Giroux, and R. C. Dage, J. Am. Chem. Soc., 109, 7914 (1987). An Acyl-Iminium Ion Cyclization Route to a Novel Conformationally Restricted Dipeptide Mimic: Applications to Angiotensin-Converting Enzyme Inhibition.
-
(1987)
J. Am. Chem. Soc.
, vol.109
, pp. 7914
-
-
Flynn, G.A.1
Giroux, E.L.2
Dage, R.C.3
-
58
-
-
0027208070
-
Angiotensin II Receptors and Angiotensin II Receptor Antagonists
-
P. B. M. W. M. Timmermans, P. C. Wong, A. T. Chiu, W. F. Herblin, P. Benfield, D. J. Carini, R. J. Lee, R. R. Wexler, J. A. M. Saye, and R. D. Smith, Pharm. Rev., 45, 205 (1993). Angiotensin II Receptors and Angiotensin II Receptor Antagonists.
-
(1993)
Pharm. Rev.
, vol.45
, pp. 205
-
-
Timmermans, P.B.M.W.M.1
Wong, P.C.2
Chiu, A.T.3
Herblin, W.F.4
Benfield, P.5
Carini, D.J.6
Lee, R.J.7
Wexler, R.R.8
Saye, J.A.M.9
Smith, R.D.10
-
59
-
-
0027717388
-
Nonpeptide Angiotensin II Receptor Antagonists
-
M. I. Steinberg, S. A. Wiest, and A. D. Palkowitz, Cardiovasc. Drug Rev., 11, 312 (1993). Nonpeptide Angiotensin II Receptor Antagonists.
-
(1993)
Cardiovasc. Drug Rev.
, vol.11
, pp. 312
-
-
Steinberg, M.I.1
Wiest, S.A.2
Palkowitz, A.D.3
-
60
-
-
19944421330
-
Angiotensin II Receptor Antagonists: Molecular Modeling
-
Pharmaco Chemistry Library, P. B. M. W. M. Timmermans and R. R. Wexler, Eds., Elsevier, New York
-
R. H. Bradbury, B. B. Masek, and D. A. Roberts, in Medicinal Chemistry of the Renin-Angiotensin System, Pharmaco Chemistry Library, 21, P. B. M. W. M. Timmermans and R. R. Wexler, Eds., Elsevier, New York, 1994, pp. 157-174. Angiotensin II Receptor Antagonists: Molecular Modeling.
-
(1994)
Medicinal Chemistry of the Renin-Angiotensin System
, vol.21
, pp. 157-174
-
-
Bradbury, R.H.1
Masek, B.B.2
Roberts, D.A.3
-
61
-
-
85068953764
-
-
U.S. Patents 4,340,598 and 4,355,040 (1982)
-
Y. Furukawa, S. Kishimoto, and K. Nishikawa, U.S. Patents 4,340,598 and 4,355,040 (1982).
-
-
-
Furukawa, Y.1
Kishimoto, S.2
Nishikawa, K.3
-
62
-
-
0025265568
-
The Discovery of Potent Nonpeptide Angiotensin II Receptor Antagonists: A New Class of Potent Antihypertensives
-
J. V. Duncia, A. T. Chiu, D. J. Carini, G. B. Gregory, A. L. Johnson, W. A. Price, G. J. Wells, P. C. Wong, J. C. Calabrese, and P. B. M. W. M. Timmermans, J. Med. Chem., 33, 1312 (1990). The Discovery of Potent Nonpeptide Angiotensin II Receptor Antagonists: A New Class of Potent Antihypertensives.
-
(1990)
J. Med. Chem.
, vol.33
, pp. 1312
-
-
Duncia, J.V.1
Chiu, A.T.2
Carini, D.J.3
Gregory, G.B.4
Johnson, A.L.5
Price, W.A.6
Wells, G.J.7
Wong, P.C.8
Calabrese, J.C.9
Timmermans, P.B.M.W.M.10
-
63
-
-
0003123729
-
Conformation of Angiotensin II
-
B. Weinstein, Ed., Dekker, New York
-
R. Smeby and S. Fermandjian, in Chemistry and Biochemistry of Amino Acids, Vol. 5, Peptides and Proteins, B. Weinstein, Ed., Dekker, New York, 1978, pp. 117-162. Conformation of Angiotensin II.
-
(1978)
Chemistry and Biochemistry of Amino Acids, Vol. 5, Peptides and Proteins
, vol.5
, pp. 117-162
-
-
Smeby, R.1
Fermandjian, S.2
-
64
-
-
0026516486
-
The Discovery of DuP 753, a Potent, Orally Active Nonpeptide Angiotensin II Receptor Antagonist
-
J. V. Duncia, D. J. Carini, A. T. Chiu, A. L. Johnson, W. A. Price, P. C. Wong, R. R. Wexler, and P. B. M. W. M. Timmermans, Med. Res. Rev., 12, 149 (1992). The Discovery of DuP 753, a Potent, Orally Active Nonpeptide Angiotensin II Receptor Antagonist.
-
(1992)
Med. Res. Rev.
, vol.12
, pp. 149
-
-
Duncia, J.V.1
Carini, D.J.2
Chiu, A.T.3
Johnson, A.L.4
Price, W.A.5
Wong, P.C.6
Wexler, R.R.7
Timmermans, P.B.M.W.M.8
-
65
-
-
0026050837
-
Nonpeptide Angiotensin II Receptor Antagonists: The Discovery of a Series of N-(Biphenylylmethyl)imidazoles as Potent, Orally Active Antihypertensives
-
See, for example, D. J. Carini, J. V. Duncia, P. E. Aldrich, A. T. Chiu, A. L. Johnson, M. E. Pierce, W. A. Price, J. B. Santella III, G. J. Wells, R. R. Wexler, P. C. Wong, S.-E. Yoo, and P. B. M. W. M. Timmermans, J. Med. Chem., 34, 2525 (1991). Nonpeptide Angiotensin II Receptor Antagonists: The Discovery of a Series of N-(Biphenylylmethyl)imidazoles as Potent, Orally Active Antihypertensives.
-
(1991)
J. Med. Chem.
, vol.34
, pp. 2525
-
-
Carini, D.J.1
Duncia, J.V.2
Aldrich, P.E.3
Chiu, A.T.4
Johnson, A.L.5
Pierce, M.E.6
Price, W.A.7
Santella III, J.B.8
Wells, G.J.9
Wexler, R.R.10
Wong, P.C.11
Yoo, S.-E.12
Timmermans, P.B.M.W.M.13
-
66
-
-
0028259061
-
Nonpeptide Angiotensin II Receptor Antagonists: The Discovery of DMP 581 and DMP 811
-
D. J. Carini, R. J. Ardecky, C. L. Ensinger, J. R. Pruitt, R. R. Wexler, P. C. Wong, S.-M. Huang, B. J. Aungst, and P. B. M. W. M. Timmermans, Dioorg. Med. Chem. Lett., 4, 63 (1994). Nonpeptide Angiotensin II Receptor Antagonists: The Discovery of DMP 581 and DMP 811, and references therein.
-
(1994)
Dioorg. Med. Chem. Lett.
, vol.4
, pp. 63
-
-
Carini, D.J.1
Ardecky, R.J.2
Ensinger, C.L.3
Pruitt, J.R.4
Wexler, R.R.5
Wong, P.C.6
Huang, S.-M.7
Aungst, B.J.8
Timmermans, P.B.M.W.M.9
-
67
-
-
0025879914
-
1-(Carboxybenzyl)imidazole-5-acrylic Acids: Potent and Selective Angiotensin II Receptor Antagonists
-
J. Weinstock, R. M. Keenan, J. Samanen, J. Hempel, J. A. Finkelstein, R. G. Franz, D. E. Gaitanopoulos, G. R. Girard, J. G. Gleason, D. T. Hill, T. M. Morgan, C. E. Peishoff, N. Aiyar, D. P. Brooks, T. A. Fredrickson, E. H. Ohlstein, R. R. Ruffolo Jr., E. J. Stack, A. C. Sulpizio, E. F. Weidley, and R. M. Edwards, J. Med. Chem. 34, 1514 (1991). 1-(Carboxybenzyl)imidazole-5-acrylic Acids: Potent and Selective Angiotensin II Receptor Antagonists.
-
(1991)
J. Med. Chem.
, vol.34
, pp. 1514
-
-
Weinstock, J.1
Keenan, R.M.2
Samanen, J.3
Hempel, J.4
Finkelstein, J.A.5
Franz, R.G.6
Gaitanopoulos, D.E.7
Girard, G.R.8
Gleason, J.G.9
Hill, D.T.10
Morgan, T.M.11
Peishoff, C.E.12
Aiyar, N.13
Brooks, D.P.14
Fredrickson, T.A.15
Ohlstein, E.H.16
Ruffolo Jr., R.R.17
Stack, E.J.18
Sulpizio, A.C.19
Weidley, E.F.20
Edwards, R.M.21
more..
-
68
-
-
0026459664
-
Imidazole-5-Acrylic Acids: Potent Nonpeptide Angiotensin II Receptor Antagonists Designed Using a Novel Peptide Pharmacophore Model
-
R. M. Keenan, J. Weinstock, J. A. Finkelstein, R. G. Franz, D. E. Gaitanopoulos, G. R. Girard, D. T. Hill, T. M. Morgan, J. M. Samanen, J. C. Hempel, D. Eggleston, N. Aiyar, E. Griffin, E. H. Ohlstein, E. J. Stack, E. F. Weidley, and R. M. Edwards, J. Med. Chem., 35, 3858 (1992). Imidazole-5-Acrylic Acids: Potent Nonpeptide Angiotensin II Receptor Antagonists Designed Using a Novel Peptide Pharmacophore Model.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 3858
-
-
Keenan, R.M.1
Weinstock, J.2
Finkelstein, J.A.3
Franz, R.G.4
Gaitanopoulos, D.E.5
Girard, G.R.6
Hill, D.T.7
Morgan, T.M.8
Samanen, J.M.9
Hempel, J.C.10
Eggleston, D.11
Aiyar, N.12
Griffin, E.13
Ohlstein, E.H.14
Stack, E.J.15
Weidley, E.F.16
Edwards, R.M.17
-
69
-
-
0027241303
-
Refinement of a Molecular Model of Angiotensin II (AII) Employed in the Discovery of Potent Nonpeptide Antagonists
-
J. M. Samanen, C. E. Peishoff, R. M. Keenan, and J. Weinstock, Bioorg. Med. Chem. Lett., 3, 909 (1993). Refinement of a Molecular Model of Angiotensin II (AII) Employed in the Discovery of Potent Nonpeptide Antagonists.
-
(1993)
Bioorg. Med. Chem. Lett.
, vol.3
, pp. 909
-
-
Samanen, J.M.1
Peishoff, C.E.2
Keenan, R.M.3
Weinstock, J.4
-
70
-
-
0027225708
-
Potent Nonpeptidic Angiotensin II Receptor Antagonists. 2. 1-(Carboxybenzyl)imidazole-5-acrylic Acids
-
R. M. Keenan, J. Weinstock, J. A. Finkelstein, R. G. Franz, D. E. Gaitanopoulos, G. R. Girard, D. T. Hill, T. M. Morgan, J. M. Samanen, C. E. Peishoff, L. M. Tucker, N. Aiyar, E. Griffin, E. H. Ohlstein, E. J. Stack, E. F. Weidley and R. M. Edwards, J. Med. Chem., 36, 1880 (1993). Potent Nonpeptidic Angiotensin II Receptor Antagonists. 2. 1-(Carboxybenzyl)imidazole-5-acrylic Acids.
-
(1993)
J. Med. Chem.
, vol.36
, pp. 1880
-
-
Keenan, R.M.1
Weinstock, J.2
Finkelstein, J.A.3
Franz, R.G.4
Gaitanopoulos, D.E.5
Girard, G.R.6
Hill, D.T.7
Morgan, T.M.8
Samanen, J.M.9
Peishoff, C.E.10
Tucker, L.M.11
Aiyar, N.12
Griffin, E.13
Ohlstein, E.H.14
Stack, E.J.15
Weidley, E.F.16
Edwards, R.M.17
-
71
-
-
85068946630
-
-
Tripos, Inc., St. Louis, MO 63144
-
Tripos, Inc., St. Louis, MO 63144.
-
-
-
-
72
-
-
0028293066
-
Designing Peptide Mimetics
-
G. J. Moore, Trends Pharmacol. Sci., 15, 124 (1994). Designing Peptide Mimetics.
-
(1994)
Trends Pharmacol. Sci.
, vol.15
, pp. 124
-
-
Moore, G.J.1
-
73
-
-
0028231547
-
Valsartan, a Potent, Orally Active Angiotensin II Antagonist Developed from the Structurally New Amino Acid Series
-
P. Bühlmayer, P. Furet, L. Criscione, M. de Gasparo, S. Whitebread, T. Schmidlin, R. Lattmann, and J. Wood, Bioorg. Med. Chem. Lett., 4, 29 (1994). Valsartan, a Potent, Orally Active Angiotensin II Antagonist Developed from the Structurally New Amino Acid Series.
-
(1994)
Bioorg. Med. Chem. Lett.
, vol.4
, pp. 29
-
-
Bühlmayer, P.1
Furet, P.2
Criscione, L.3
De Gasparo, M.4
Whitebread, S.5
Schmidlin, T.6
Lattmann, R.7
Wood, J.8
-
74
-
-
0028578769
-
Structural Evolution and Pharmacology of a Novel Series of Triacid Angiotensin II Receptor Antagonists
-
A. D. Palkowitz, M. I. Steinberg, K. J. Thrasher, J. K. Reel, K. L. Hauser, K. M. Zimmerman, S. A. Wiest, C. A. Whitesitt, R. L. Simon, W. Pfeifer, S. L. Lifer, D. B. Boyd, C. J. Barnett, T. M. Wilson, J. B. Deeter, K. Takeuchi, R. E. Ritey, W. D. Miller, and W. S. Marshall, J. Med. Chem., 37, 4508 (1994). Structural Evolution and Pharmacology of a Novel Series of Triacid Angiotensin II Receptor Antagonists.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 4508
-
-
Palkowitz, A.D.1
Steinberg, M.I.2
Thrasher, K.J.3
Reel, J.K.4
Hauser, K.L.5
Zimmerman, K.M.6
Wiest, S.A.7
Whitesitt, C.A.8
Simon, R.L.9
Pfeifer, W.10
Lifer, S.L.11
Boyd, D.B.12
Barnett, C.J.13
Wilson, T.M.14
Deeter, J.B.15
Takeuchi, K.16
Ritey, R.E.17
Miller, W.D.18
Marshall, W.S.19
-
75
-
-
15444355069
-
Molecular Modeling and Quantitative Structure-Activity Relationship Studies in Pursuit of Highly Potent Substituted Octanoamide Angiotensin II Receptor Antagonists
-
C. H. Reynolds, M. K. Holloway, and H. K. Cox, Eds., American Chemical Society, Washington, DC
-
D. B. Boyd, A. D. Palkowirz, J. Thrasher, K. L. Hauser, C. A. Whitesitt, J. K. Reel., R. L. Simon, W. Pfeifer, S. L. Lifer, K. Takeuchi, V. Vasudevan, A. D. Kossoy, J. B. Deeter, M. I. Steinberg, K. M. Zimmerman, S. A. Wiest, and W. S. Marshall, in Comptiter-Aided Molecular Design. Applications in Agrochemicals, Materials, and Pharmaceutical, C. H. Reynolds, M. K. Holloway, and H. K. Cox, Eds., American Chemical Society, Washington, DC, 1995, pp. 14-35. Molecular Modeling and Quantitative Structure-Activity Relationship Studies in Pursuit of Highly Potent Substituted Octanoamide Angiotensin II Receptor Antagonists.
-
(1995)
Comptiter-Aided Molecular Design. Applications in Agrochemicals, Materials, and Pharmaceutical
, pp. 14-35
-
-
Boyd, D.B.1
Palkowirz, A.D.2
Thrasher, J.3
Hauser, K.L.4
Whitesitt, C.A.5
Reel, J.K.6
Simon, R.L.7
Pfeifer, W.8
Lifer, S.L.9
Takeuchi, K.10
Vasudevan, V.11
Kossoy, A.D.12
Deeter, J.B.13
Steinberg, M.I.14
Zimmerman, K.M.15
Wiest, S.A.16
Marshall, W.S.17
-
76
-
-
85068948085
-
-
(IUPUI), personal communication
-
D. B. Boyd (IUPUI), personal communication, 1995.
-
(1995)
-
-
Boyd, D.B.1
-
77
-
-
0028527350
-
Derivation of a 3D Pharmacophore Model for the Angiotensin-II Site One Receptor
-
K. Prendergast, K. Adams, W. J. Greenlee, R. B. Nachbar, A. A. Patchett, and D. J. Underwood, J. Comput.-Aided Mol. Design, 8, 491 (1994). Derivation of a 3D Pharmacophore Model for the Angiotensin-II Site One Receptor.
-
(1994)
J. Comput.-Aided Mol. Design
, vol.8
, pp. 491
-
-
Prendergast, K.1
Adams, K.2
Greenlee, W.J.3
Nachbar, R.B.4
Patchett, A.A.5
Underwood, D.J.6
-
78
-
-
0024538318
-
Neutral Endopeptidase 24.11 (Enkephalinase) and Related Regulators of Peptide Hormones
-
E. G. Erdös and R. A. Skidgel, FASEB J., 3, 145 (1989). Neutral Endopeptidase 24.11 (Enkephalinase) and Related Regulators of Peptide Hormones.
-
(1989)
FASEB J.
, vol.3
, pp. 145
-
-
Erdös, E.G.1
Skidgel, R.A.2
-
79
-
-
0027180453
-
Application of a Conformationally Restricted Phe-Leu Dipeptide Mimetic to the Design of a Combined Inhibitor of Angiotensin-I Converting Enzyme and Neutral Endopeptidase 24.11
-
G. A. Flynn, D. W. Beight, S. Mehdi, J. R. Koehl, E. L. Giroux, J. F. French, P. W. Hake, and R. C. Dage,J. Med. Chem., 36, 2420 (1993). Application of a Conformationally Restricted Phe-Leu Dipeptide Mimetic to the Design of a Combined Inhibitor of Angiotensin-I Converting Enzyme and Neutral Endopeptidase 24.11.
-
(1993)
J. Med. Chem.
, vol.36
, pp. 2420
-
-
Flynn, G.A.1
Beight, D.W.2
Mehdi, S.3
Koehl, J.R.4
Giroux, E.L.5
French, J.F.6
Hake, P.W.7
Dage, R.C.8
-
80
-
-
85068954755
-
-
BIOSYM Technologies, San Diego, CA 92121
-
BIOSYM Technologies, San Diego, CA 92121.
-
-
-
-
81
-
-
0028299371
-
New Dual Inhibitors of Neutral Endopeptidase and Angiotensin-Converting Enzyme: Rational Design, Bioavailability, and Pharmacological Responses in Experimental Hypertension
-
M.-C. Fournié-Zaluski, P. Coric, S. Turcaud, N. Rousselet, W. Gonzalez, B. Barbe, I. Pham, N. Jullian, J.-B. Michel, and B. P. Roques, J. Med. Chem., 37, 1070 (1994). New Dual Inhibitors of Neutral Endopeptidase and Angiotensin-Converting Enzyme: Rational Design, Bioavailability, and Pharmacological Responses in Experimental Hypertension. See also references therein.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 1070
-
-
Fournié-Zaluski, M.-C.1
Coric, P.2
Turcaud, S.3
Rousselet, N.4
Gonzalez, W.5
Barbe, B.6
Pham, I.7
Jullian, N.8
Michel, J.-B.9
Roques, B.P.10
-
82
-
-
0024334170
-
Role of Human Immunodeficiency Virus Type 1-Specific Protease in Core Protein Maturation and Viral Infectivity
-
See, for example, C. Peng, B. K. Ho, T. W. Chang, and N. T. Chang, J. Virol., 63, 2550 (1989). Role of Human Immunodeficiency Virus Type 1-Specific Protease in Core Protein Maturation and Viral Infectivity.
-
(1989)
J. Virol.
, vol.63
, pp. 2550
-
-
Peng, C.1
Ho, B.K.2
Chang, T.W.3
Chang, N.T.4
-
83
-
-
0024344021
-
Structure of a Complex of Synthetic HIV-1-Protease with a Substrate-Based Inhibitor at 2.3 Å Resolution
-
M. Miller, J. Schneider, B. K. Sathyanarayan, M. V. Toth, G. R. Marshall, L. Clawson, L. Selk, S. B. H. Kent, and A. Wlodawer, Science, 246, 1149 (1989). Structure of a Complex of Synthetic HIV-1-Protease with a Substrate-Based Inhibitor at 2.3 Å Resolution.
-
(1989)
Science
, vol.246
, pp. 1149
-
-
Miller, M.1
Schneider, J.2
Sathyanarayan, B.K.3
Toth, M.V.4
Marshall, G.R.5
Clawson, L.6
Selk, L.7
Kent, S.B.H.8
Wlodawer, A.9
-
84
-
-
0025225682
-
X-Ray Cristallographic Structure of a Complex between a Synthetic Protease of Human Immunodeficiency Virus 1 and a Substrate-Based Hydroxyethylamine Inhibitor
-
A. L. Swain, M. M. Miller, J. Green, D. H. Rich, J. Schneider, S. B. H. Kent, and A. Wlodawer, Proc. Natl. Acad. Sci., U.S.A., 87, 8805 (1990). X-Ray Cristallographic Structure of a Complex Between a Synthetic Protease of Human Immunodeficiency Virus 1 and a Substrate-Based Hydroxyethylamine Inhibitor.
-
(1990)
Proc. Natl. Acad. Sci., U.S.A.
, vol.87
, pp. 8805
-
-
Swain, A.L.1
Miller, M.M.2
Green, J.3
Rich, D.H.4
Schneider, J.5
Kent, S.B.H.6
Wlodawer, A.7
-
85
-
-
0002039443
-
HIV Protease: Structure-Based Design
-
M. Clare, Perspect. Drug Discovery Design, 1, 49 (1993). HIV Protease: Structure-Based Design.
-
(1993)
Perspect. Drug Discovery Design
, vol.1
, pp. 49
-
-
Clare, M.1
-
86
-
-
0028452628
-
A Shape- and Chemistry-Based Docking Method and its Use in the Design of HIV-1 Protease Inhibitors
-
See, for example, R. L. Desjarlais, and J. S. Dixon, J. Comput.-Aided Mol. Design, 8, 231 (1994). A Shape- and Chemistry-Based Docking Method and its Use in the Design of HIV-1 Protease Inhibitors.
-
(1994)
J. Comput.-Aided Mol. Design
, vol.8
, pp. 231
-
-
Desjarlais, R.L.1
Dixon, J.S.2
-
87
-
-
0029028338
-
Use of Molecular Dynamics and Free Energy Perturbation Calculations in Anti-Human Immunodeficiency Virus Drug Design
-
M. A. McCarrick and P. Kollman, Methods Enzymol, 241, 370 (1994). Use of Molecular Dynamics and Free Energy Perturbation Calculations in Anti-Human Immunodeficiency Virus Drug Design.
-
(1994)
Methods Enzymol
, vol.241
, pp. 370
-
-
McCarrick, M.A.1
Kollman, P.2
-
88
-
-
0028096657
-
Design, Synthesis and Activity of Conformationally Constrained Macrocyclic Peptide-Based Inhibitors of HIV Protease
-
R. A. Smith, P. J. Coles, J. J. Chen, V. J. Robinson, I. D. MacDonald, J. Carrière, and A. Krantz, Bioorg. Med. Chem. Lett., 4, 2217 (1994). Design, Synthesis and Activity of Conformationally Constrained Macrocyclic Peptide-Based Inhibitors of HIV Protease.
-
(1994)
Bioorg. Med. Chem. Lett.
, vol.4
, pp. 2217
-
-
Smith, R.A.1
Coles, P.J.2
Chen, J.J.3
Robinson, V.J.4
MacDonald, I.D.5
Carrière, J.6
Krantz, A.7
-
89
-
-
0028349919
-
Calculation of Relative Differences in the Binding Free Energies of HIV-1 Protease Inhibitors: A Thermodynamic Cycle Perturbation Approach
-
M. R. Reddy, M. D. Varney, V. Kalish, V. N. Viswanadhan, and K. Appelt, J. Med. Chem., 37, 1145 (1994). Calculation of Relative Differences in the Binding Free Energies of HIV-1 Protease Inhibitors: A Thermodynamic Cycle Perturbation Approach.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 1145
-
-
Reddy, M.R.1
Varney, M.D.2
Kalish, V.3
Viswanadhan, V.N.4
Appelt, K.5
-
90
-
-
0027931684
-
Crystal-Structure-Based Design and Synthesis of Novel C-Terminal Inhibitors of HIV Protease
-
M. D. Varney, K. Appelt, V. Kalish, M. R. Reddy, J. Tatlock, C. L. Palmer, W. H. Romines, B.-W. Wu, and L. Musick, J. Med. Chem., 37, 2274 (1994). Crystal-Structure-Based Design and Synthesis of Novel C-Terminal Inhibitors of HIV Protease.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 2274
-
-
Varney, M.D.1
Appelt, K.2
Kalish, V.3
Reddy, M.R.4
Tatlock, J.5
Palmer, C.L.6
Romines, W.H.7
Wu, B.-W.8
Musick, L.9
-
91
-
-
0024792446
-
Inhibition of Human Immunodeficiency Virus 1 Protease in Vitro: Rational Design of Substrate Analogue Inhibitors
-
G. B. Dreyer, B. W. Metcalf, T. A. Tomaszek, T. J. Carr, A. C. Chandler III, L. Hyland, S. A. Fakhoury, V. W. Magaard, M. L. Moore, J. E. Strickler, C. Debouck, and T. D. Meek, Proc. Natl. Acad. Sci. U.S.A., 86, 9752 (1989). Inhibition of Human Immunodeficiency Virus 1 Protease In Vitro: Rational Design of Substrate Analogue Inhibitors.
-
(1989)
Proc. Natl. Acad. Sci. U.S.A.
, vol.86
, pp. 9752
-
-
Dreyer, G.B.1
Metcalf, B.W.2
Tomaszek, T.A.3
Carr, T.J.4
Chandler III, A.C.5
Hyland, L.6
Fakhoury, S.A.7
Magaard, V.W.8
Moore, M.L.9
Strickler, J.E.10
Debouck, C.11
Meek, T.D.12
-
92
-
-
0842341771
-
A New General Quantum Mechanical Molecular Model
-
M. J. S. Dewar, E. G. Zoebisch, E. F. Healy, and J. J. P. Stewart, J. Am. Chem. Soc., 107, 3902 (1985). A New General Quantum Mechanical Molecular Model.
-
(1985)
J. Am. Chem. Soc.
, vol.107
, pp. 3902
-
-
Dewar, M.J.S.1
Zoebisch, E.G.2
Healy, E.F.3
Stewart, J.J.P.4
-
93
-
-
45149145779
-
The Dielectric Constant of SPCJE Water
-
See, for example, M. R. Reddy and M. Berkowitz, Chem. Phys. Lett., 155, 173 (1989). The Dielectric Constant of SPCJE Water. See also references therein.
-
(1989)
Chem. Phys. Lett.
, vol.155
, pp. 173
-
-
Reddy, M.R.1
Berkowitz, M.2
-
94
-
-
0028057975
-
Rational Design of Potent, Bioavailable, Nonpeptide Cyclic Ureas as HIV Protease Inhibitors
-
P. Y. S. Lam, P. K. Jadhav, C. J. Eyermann, C. N. Hodge, Y. Ru, L. T. Bacheler, J. L. Meek, M. J. Otto, M. M. Rayner, Y. N. Wong, C.-H. Chang, P. C. Weber, D. A. Jackson, T. R. Sharpe, and S. Erickson-Viitanen, Science, 263, 380 (1994). Rational Design of Potent, Bioavailable, Nonpeptide Cyclic Ureas as HIV Protease Inhibitors.
-
(1994)
Science
, vol.263
, pp. 380
-
-
Lam, P.Y.S.1
Jadhav, P.K.2
Eyermann, C.J.3
Hodge, C.N.4
Ru, Y.5
Bacheler, L.T.6
Meek, J.L.7
Otto, M.J.8
Rayner, M.M.9
Wong, Y.N.10
Chang, C.-H.11
Weber, P.C.12
Jackson, D.A.13
Sharpe, T.R.14
Erickson-Viitanen, S.15
-
95
-
-
0001835759
-
3D Search and Research Using the Cambridge Structural Database
-
F. H. Allen and O. Kennard, Chem. Design Autant. News, 8, 31 (1993). 3D Search and Research Using the Cambridge Structural Database.
-
(1993)
Chem. Design Autant. News
, vol.8
, pp. 31
-
-
Allen, F.H.1
Kennard, O.2
-
96
-
-
85068946505
-
-
MDL Information Systems, Inc., San Leandro, CA 94577
-
MDL Information Systems, Inc., San Leandro, CA 94577.
-
-
-
-
97
-
-
0024992935
-
2 Symmetric Inhibitor Complexed to HIV-1 Protease
-
2 Symmetric Inhibitor Complexed to HIV-1 Protease.
-
(1990)
Science
, vol.249
, pp. 527
-
-
Erickson, J.W.1
Neidhart, D.J.2
VanDrie, J.3
Kempf, D.J.4
Wang, X.C.5
Norbeck, D.W.6
Plattner, J.J.7
Rittenhouse, J.W.8
Turon, M.9
Wideburg, N.10
Kohlbrenner, W.E.11
Simmer, R.12
Helfrich, R.13
Paul, D.A.14
Knigge, M.15
-
98
-
-
0028287967
-
De Novo Design of Nonpeptidic HIV-1 Protease Inhibitors: Incorporation of Structural Water
-
R. S. Randad, W. Pan, S. V. Gulnik, S. Burt, and J. W. Erickson, Bioorg. Med. Chem. Lett., 4, 1247 (1994). De Novo Design of Nonpeptidic HIV-1 Protease Inhibitors: Incorporation of Structural Water.
-
(1994)
Bioorg. Med. Chem. Lett.
, vol.4
, pp. 1247
-
-
Randad, R.S.1
Pan, W.2
Gulnik, S.V.3
Burt, S.4
Erickson, J.W.5
-
99
-
-
0028020289
-
Design, Synthesis, and Conformational Analysis of a Novel Macrocyclic HIV-Protease Inhibitor
-
B. L. Podlogar, R. A. Farr, D. Friedrich, C. Tarnus, E. W. Huber, R. J. Cregge, and D. Schirlin, J. Med. Chem., 37, 3684 (1994). Design, Synthesis, and Conformational Analysis of a Novel Macrocyclic HIV-Protease Inhibitor.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 3684
-
-
Podlogar, B.L.1
Farr, R.A.2
Friedrich, D.3
Tarnus, C.4
Huber, E.W.5
Cregge, R.J.6
Schirlin, D.7
-
100
-
-
0027234908
-
3-Ligands
-
3-Ligands.
-
(1993)
J. Med. Chem.
, vol.36
, pp. 2300
-
-
Ghosh, A.K.1
Thompson, W.J.2
Holloway, M.K.3
McKee, S.P.4
Duong, T.T.5
Lee, H.Y.6
Munson, P.M.7
Smith, A.M.8
Wai, J.M.9
Darke, P.L.10
Zugay, J.A.11
Emini, E.A.12
Schleif, W.A.13
Huff, J.R.14
Anderson, P.S.15
-
101
-
-
0026627809
-
1′ Phenyl Substituents: X-Ray Crystal Structure Assisted Design
-
1′ Phenyl Substituents: X-Ray Crystal Structure Assisted Design.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 1685
-
-
Thompson, W.J.1
Fitzgerald, P.M.D.2
Holloway, M.K.3
Emini, E.A.4
Darke, P.L.5
McKeever, B.M.6
Schleif, W.A.7
Quintero, J.C.8
Zugay, J.A.9
Tucker, T.J.10
Schwering, J.E.11
Homnick, C.F.12
Nunberg, J.13
Springer, J.P.14
Huff, J.R.15
-
102
-
-
0029063951
-
A Priori Prediction of Activity for HIV-1 Protease Inhibitors Employing Energy Minimization in the Active Site
-
T. A. Halgren, Merck Sharp and Dohme Research Laboratories, Rahway, NJ
-
T. A. Halgren, Merck Sharp and Dohme Research Laboratories, Rahway, NJ. OPTIMOL uses partial charges on atoms and lacks unshared pairs of electrons on certain nitrogen and oxygen atoms. See also, M. K. Holloway, J. M. Wai, T. A. Halgren, P. M. D. Fitzgerald, J. P. Vacca, B. D. Dorsey, R. B. Levin, W. J. Thompson, L. J. Chen, S. J. deSolms, N. Gaffin, A, K. Ghosh, E. A. Giuliani, S. L. Graham, J. P. Guare, R. W. Hungate, T. A. LyIe, W. M. Sanders, T. J. Tucker, M. Wiggins, C. M. Wiscount, O. W. Woltersdorf, S. D. Young, P.L. Darke, and J. A. Zugay, J. Med. Chem., 38, 305 (1995). A Priori Prediction of Activity for HIV-1 Protease Inhibitors Employing Energy Minimization in the Active Site.
-
(1995)
J. Med. Chem.
, vol.38
, pp. 305
-
-
Holloway, M.K.1
Wai, J.M.2
Halgren, T.A.3
Fitzgerald, P.M.D.4
Vacca, J.P.5
Dorsey, B.D.6
Levin, R.B.7
Thompson, W.J.8
Chen, L.J.9
DeSolms, S.J.10
Gaffin, N.11
Ghosh, A.K.12
Giuliani, E.A.13
Graham, S.L.14
Guare, J.P.15
Hungate, R.W.16
LyIe, T.A.17
Sanders, W.M.18
Tucker, T.J.19
Wiggins, M.20
Wiscount, C.M.21
Woltersdorf, O.W.22
Young, S.D.23
Darke, P.L.24
Zugay, J.A.25
more..
-
103
-
-
0028207394
-
2 Ligands for HIV-1 Protease Inhibitors
-
2 Ligands for HIV-1 Protease Inhibitors.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 1177
-
-
Ghosh, A.K.1
Lee, H.Y.2
Thompson, W.J.3
Culberson, C.4
Holloway, M.K.5
McKee, S.P.6
Munson, P.M.7
Duong, T.T.8
Smith, A.M.9
Darke, P.L.10
Zugay, J.A.11
Emini, E.A.12
Schleif, W.A.13
Huff, J.R.14
Anderson, P.S.15
-
104
-
-
0028114145
-
Novel Conformationally Constrained HIV-I Protease Inhibitors: Rational Design, Enzyme Inhibition, and X-Ray Structure of an Enzyme-Inhibitor Complex
-
B. M. Kim, J. P. Vacca, P. M. D. Fitzgerald, P. L. Darke, M. K. Holloway, J. P. Guare, C. M. Hanifin, D. J. Arford-Bickerstaff, J. A. Zugay, J. M. Wai, P. S. Anderson, and J. R. Huff, Bioorg. Med. Chem. Lett., 4, 2199 (1994). Novel Conformationally Constrained HIV-I Protease Inhibitors: Rational Design, Enzyme Inhibition, and X-Ray Structure of an Enzyme-Inhibitor Complex.
-
(1994)
Bioorg. Med. Chem. Lett.
, vol.4
, pp. 2199
-
-
Kim, B.M.1
Vacca, J.P.2
Fitzgerald, P.M.D.3
Darke, P.L.4
Holloway, M.K.5
Guare, J.P.6
Hanifin, C.M.7
Arford-Bickerstaff, D.J.8
Zugay, J.A.9
Wai, J.M.10
Anderson, P.S.11
Huff, J.R.12
-
105
-
-
0027969994
-
L-735,524: The Design of a Potent and Orally Bioavailable HIV Protease Inhibitor
-
B. D. Dorsey, R. B. Levin, S. L. McDaniel, J. P. Vacca, J. P. Guare, P. L. Darke, J. A. Zugay, E. A. Emini, W. A. Schleif, J. C. Quintero, J. H. Lin, I.-W. Chen, M. K. Holloway, P. M. D. Fitzgerald, M. G. Axel, D. Ostovic, P. S. Anderson, and J. R. Huff, J. Med. Chem., 37, 3443 (1994). L-735,524: The Design of a Potent and Orally Bioavailable HIV Protease Inhibitor.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 3443
-
-
Dorsey, B.D.1
Levin, R.B.2
McDaniel, S.L.3
Vacca, J.P.4
Guare, J.P.5
Darke, P.L.6
Zugay, J.A.7
Emini, E.A.8
Schleif, W.A.9
Quintero, J.C.10
Lin, J.H.11
Chen, I.-W.12
Holloway, M.K.13
Fitzgerald, P.M.D.14
Axel, M.G.15
Ostovic, D.16
Anderson, P.S.17
Huff, J.R.18
-
106
-
-
0039837427
-
Structure-Based Design of Human Immunodeficiency Virus-1 Protease Inhibitors: Correlating Calculated Energy with Activity
-
Computer-Aided Molecular Design: Applications in Agrochemicals, Materials, and Pharmaceutical. March 13-17, 1994, San Diego, CA, C. H. Reynolds, M. K. Holloway, and H. K. Cox, Eds., American Chemical Society, Washington, DC
-
See also, M. K. Holloway and J. M. Wai, in Computer-Aided Molecular Design: Applications in Agrochemicals, Materials, and Pharmaceutical. (A symposium at the 207th American Chemical Society National Meeting, March 13-17, 1994, San Diego, CA), C. H. Reynolds, M. K. Holloway, and H. K. Cox, Eds., American Chemical Society, Washington, DC, 1995, pp. 36-50. Structure-Based Design of Human Immunodeficiency Virus-1 Protease Inhibitors: Correlating Calculated Energy with Activity.
-
(1995)
A Symposium at the 207th American Chemical Society National Meeting
, pp. 36-50
-
-
Holloway, M.K.1
Wai, J.M.2
-
107
-
-
85068946951
-
-
Merck Research Laboratories, unpublished results
-
P. M. D. Fitzgerald, Merck Research Laboratories, unpublished results.
-
-
-
Fitzgerald, P.M.D.1
-
108
-
-
0028113650
-
2′ Amide Bond Isostere
-
2′ Amide Bond Isostere.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 3100
-
-
Thompson, S.K.1
Murthy, K.H.M.2
Zhao, B.3
Winborne, E.4
Green, D.W.5
Fisher, S.M.6
Desjarlais, R.L.7
Tomaszek Jr., T.A.8
Meek, T.D.9
Gleason, J.G.10
Abdel-Meguid, S.S.11
-
109
-
-
85068949658
-
An Orally Bioavailable HIV-I Protease Inhibitor Containing an Imidazole-Derived Peptide Bond Replacement: Crystallographic and Pharmacokinetic Analysis
-
S. S. Abdel-Meguid, B. W. Metcalf, T. J. Carr, P. Demarsh, R. L. Desjarlais, S. Fisher, D. W. Green, L. Ivanoff, D. M. Lambert, K. H. M. Murthy, S. R. Petteway Jr., W. J. Pitts, T. A. Tomaszek Jr., E. Winborne, B. Zhao, G. B. Dryer, T. D. Meek, Biochemistry, 33, 1671 (1994). An Orally Bioavailable HIV-I Protease Inhibitor Containing an Imidazole-Derived Peptide Bond Replacement: Crystallographic and Pharmacokinetic Analysis.
-
(1994)
Biochemistry
, vol.33
, pp. 1671
-
-
Abdel-Meguid, S.S.1
Metcalf, B.W.2
Carr, T.J.3
Demarsh, P.4
Desjarlais, R.L.5
Fisher, S.6
Green, D.W.7
Ivanoff, L.8
Lambert, D.M.9
Murthy, K.H.M.10
Petteway Jr., S.R.11
Pitts, W.J.12
Tomaszek Jr., T.A.13
Winborne, E.14
Zhao, B.15
Dryer, G.B.16
Meek, T.D.17
-
110
-
-
0028261775
-
Design, Structure Activity and X-Ray Crystallographic Studies of Pseudo-Symmetrical Nonpeptidyl HIV-I Protease Inhibitors
-
R. E. Babine, N. Zhang, S. R. Schow, Z. Xu, R. A. Byrn, R. C. Hastings, M. F. Semmelhack, M. W. Wick, and S. S. Kerwar, Bioorg. Med. Chem. Lett. 4, 583 (1994). Design, Structure Activity and X-Ray Crystallographic Studies of Pseudo-Symmetrical Nonpeptidyl HIV-I Protease Inhibitors.
-
(1994)
Bioorg. Med. Chem. Lett.
, vol.4
, pp. 583
-
-
Babine, R.E.1
Zhang, N.2
Schow, S.R.3
Xu, Z.4
Byrn, R.A.5
Hastings, R.C.6
Semmelhack, M.F.7
Wick, M.W.8
Kerwar, S.S.9
-
111
-
-
0027742264
-
Peptidomimetics of the Immunoglobulin Supergene Family - A Review
-
H. Nakanishi, S. Ramurthy, A. Raktabutr, R. Shen, and M. Kahn, Gene, 137, 51 (1993). Peptidomimetics of the Immunoglobulin Supergene Family - A Review.
-
(1993)
Gene
, vol.137
, pp. 51
-
-
Nakanishi, H.1
Ramurthy, S.2
Raktabutr, A.3
Shen, R.4
Kahn, M.5
-
112
-
-
0023840802
-
The CD4 Antigen: Physiological Ligand and HIV Receptor
-
Q. J. Sattentau and R. A. Weiss, Cell, 52, 631 (1988). The CD4 Antigen: Physiological Ligand and HIV Receptor.
-
(1988)
Cell
, vol.52
, pp. 631
-
-
Sattentau, Q.J.1
Weiss, R.A.2
-
113
-
-
0025198478
-
Atomic Structure of a Fragment of Human CD4 Containing Two Immunoglobulin-Like Domains
-
J. Wang, Y. Yan, T. P. J. Garrett, J. Lui, D. W. Rodgers, R. L. Garlick, G. E. Tarr, Y. Husain, E. L. Reinherz, and S. C. Harrison, Nature, 348, 411 (1990). Atomic Structure of a Fragment of Human CD4 Containing Two Immunoglobulin-Like Domains.
-
(1990)
Nature
, vol.348
, pp. 411
-
-
Wang, J.1
Yan, Y.2
Garrett, T.P.J.3
Lui, J.4
Rodgers, D.W.5
Garlick, R.L.6
Tarr, G.E.7
Husain, Y.8
Reinherz, E.L.9
Harrison, S.C.10
-
114
-
-
0025224767
-
Crystal Structure of an HIV-Binding Recombinant Fragment of Human CD4
-
S.-E. Ryu, P. D. Kwong, A. Truneh, T. G. Porter, J. Arthos, M. Rosenberg, X. Dai, N.-H. Xuong, R. Axel, R. W. Sweet, and W. A. Hendrickson, Nature, 348, 419 (1990). Crystal Structure of an HIV-Binding Recombinant Fragment of Human CD4.
-
(1990)
Nature
, vol.348
, pp. 419
-
-
Ryu, S.-E.1
Kwong, P.D.2
Truneh, A.3
Porter, T.G.4
Arthos, J.5
Rosenberg, M.6
Dai, X.7
Xuong, N.-H.8
Axel, R.9
Sweet, R.W.10
Hendrickson, W.A.11
-
115
-
-
0026637125
-
Design and Synthesis of a CD4 β-Turn Mimetic That Inhibits Human Immunodeficiency Virus Envelope Glycoprotein gp120 Binding and Infection of Human Lymphocytes
-
S. Chen, R. A. Chrusciel, H. Nakanishi, A. Raktabutr, M. E. Johnson, A. Sato, D. Veiner, J. Hoxie, H. U. Saragovi, M. I. Greene, and M. Kahn, Proc. Natl. Acad. Sci. U.S.A., 89, 5872 (1992). Design and Synthesis of a CD4 β-Turn Mimetic That Inhibits Human Immunodeficiency Virus Envelope Glycoprotein gp120 Binding and Infection of Human Lymphocytes.
-
(1992)
Proc. Natl. Acad. Sci. U.S.A.
, vol.89
, pp. 5872
-
-
Chen, S.1
Chrusciel, R.A.2
Nakanishi, H.3
Raktabutr, A.4
Johnson, M.E.5
Sato, A.6
Veiner, D.7
Hoxie, J.8
Saragovi, H.U.9
Greene, M.I.10
Kahn, M.11
-
116
-
-
0344778061
-
Semianalytical Treatment of Solvation for Molecular Mechanics and Dynamics
-
W. C. Still, A. Tempczyk, R. C. Hawley, and T. Hendrickson, J. Am. Chem. Soc., 112, 6127 (1990). Semianalytical Treatment of Solvation for Molecular Mechanics and Dynamics.
-
(1990)
J. Am. Chem. Soc.
, vol.112
, pp. 6127
-
-
Still, W.C.1
Tempczyk, A.2
Hawley, R.C.3
Hendrickson, T.4
-
117
-
-
0028340743
-
Structure-Based Design of an Inhibitor of the Zinc Peptidase Thermolysin
-
B. P. Morgan, D. R. Holland, B. W. Matthews, and P. A. Bartlett, J. Am. Chem. Soc., 116, 3251 (1994). Structure-Based Design of an Inhibitor of the Zinc Peptidase Thermolysin.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 3251
-
-
Morgan, B.P.1
Holland, D.R.2
Matthews, B.W.3
Bartlett, P.A.4
-
118
-
-
9144240095
-
A Generic Force Field for Molecular Simulations
-
S. L. Mayo, B. D. Olafson, and W. A. Goddard III, J. Phys. Chem., 94, 8897 (1990). A Generic Force Field for Molecular Simulations.
-
(1990)
J. Phys. Chem.
, vol.94
, pp. 8897
-
-
Mayo, S.L.1
Olafson, B.D.2
Goddard III, W.A.3
-
119
-
-
0027207873
-
Cyclopropanes as Conformationally Restricted Peptide Isosteres. Design and Synthesis of Novel Collagenase Inhibitors
-
S. F. Martin, C. J. Oalmann, and S. Liras, Tetrahedron, 49, 3521 (1993). Cyclopropanes as Conformationally Restricted Peptide Isosteres. Design and Synthesis of Novel Collagenase Inhibitors.
-
(1993)
Tetrahedron
, vol.49
, pp. 3521
-
-
Martin, S.F.1
Oalmann, C.J.2
Liras, S.3
-
120
-
-
0022486526
-
Crystal Structure Determination, Refinement, and the Molecular Model of the α-Amylase Inhibitor HOE-467A
-
J. W. Pflugrath, G. Wiegand, R. Huber, and L. Vértesy, J. Mol. Biol. 189, 383 (1986). Crystal Structure Determination, Refinement, and the Molecular Model of the α-Amylase Inhibitor HOE-467A.
-
(1986)
J. Mol. Biol.
, vol.189
, pp. 383
-
-
Pflugrath, J.W.1
Wiegand, G.2
Huber, R.3
Vértesy, L.4
-
121
-
-
0024239356
-
Determination of the Complete Three-Dimensional Structure of the á-Amylase Inhibitor Tendamistat in Aqueous Solution by Nuclear Magnetic Resonance and Distance Geometry
-
A. D. Kline, W. Braun, and K. Wüthrich, J. Mol. Biol., 204, 675 (1988). Determination of the Complete Three-Dimensional Structure of the á-Amylase Inhibitor Tendamistat in Aqueous Solution by Nuclear Magnetic Resonance and Distance Geometry.
-
(1988)
J. Mol. Biol.
, vol.204
, pp. 675
-
-
Kline, A.D.1
Braun, W.2
Wüthrich, K.3
-
122
-
-
0028139017
-
Cyclic Hexapeptides and Chimeric Peptides and Mimics of Tendamistat
-
F. A. Etzkorn, T. Guo, M. A. Lipton, S. D. Goldberg, and P. A. Bartlett, J. Am. Chem. Soc., 116, 10412 (1994). Cyclic Hexapeptides and Chimeric Peptides and Mimics of Tendamistat.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 10412
-
-
Etzkorn, F.A.1
Guo, T.2
Lipton, M.A.3
Goldberg, S.D.4
Bartlett, P.A.5
-
123
-
-
0003495713
-
CAVEAT: A Program to Facilitate the Structure-Derived Design of Biologically Active Molecules
-
S. M. Roberts, Ed., Royal Society of Chemistry, London
-
P. A. Bartlett, G. T. Shea, S. J. Telfer, and S. Waterman, in Molecular Recognition: Chemical and Biological Problems, S. M. Roberts, Ed., Royal Society of Chemistry, London, 1989, pp. 182-196. CAVEAT: A Program to Facilitate the Structure-Derived Design of Biologically Active Molecules.
-
(1989)
Molecular Recognition: Chemical and Biological Problems
, pp. 182-196
-
-
Bartlett, P.A.1
Shea, G.T.2
Telfer, S.J.3
Waterman, S.4
-
124
-
-
0028380643
-
CAVEAT: A Program to Facilitate the Design of Organic Molecules
-
G. Lauri and P. A. Bartlett, J. Compitt.-Aided Mol. Design, 8, 51 (1994). CAVEAT: A Program to Facilitate the Design of Organic Molecules.
-
(1994)
J. Compitt.-Aided Mol. Design
, vol.8
, pp. 51
-
-
Lauri, G.1
Bartlett, P.A.2
-
125
-
-
0028136087
-
Nonpeptidic Fibrinogen Receptor Antagonists
-
V. Austel, F. Himmelsbach, and T. Müller, Drags Future, 19, 757 (1994). Nonpeptidic Fibrinogen Receptor Antagonists.
-
(1994)
Drags Future
, vol.19
, pp. 757
-
-
Austel, V.1
Himmelsbach, F.2
Müller, T.3
-
126
-
-
0026483379
-
Investigation of Conformational Specificity at GPIIb/IIIa: Evaluation of Conformationally Constrained RGD Peptides
-
C. E. Peishoff, F. E. Ali, J. W. Bean, R. Calvo, C. A. D'Ambrosio, D. S. Eggleston, S. M. Hwang, T. P. Kline, P. F. Koster, A. Nichols, D. Powers, T. Romoff, J. M. Samanen, J. Stadel, J. A. Vasko, and K. D. Kopple, J. Med. Chem., 35, 3692 (1992). Investigation of Conformational Specificity at GPIIb/IIIa: Evaluation of Conformationally Constrained RGD Peptides.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 3692
-
-
Peishoff, C.E.1
Ali, F.E.2
Bean, J.W.3
Calvo, R.4
D'Ambrosio, C.A.5
Eggleston, D.S.6
Hwang, S.M.7
Kline, T.P.8
Koster, P.F.9
Nichols, A.10
Powers, D.11
Romoff, T.12
Samanen, J.M.13
Stadel, J.14
Vasko, J.A.15
Kopple, K.D.16
-
127
-
-
0026615094
-
Design and Synthesis of a C7 Mimetic for the Predicted γ-Turn Conformation Found in Several Constrained RGD Antagonists
-
J. F. Callahan, J. W. Bean, J. L. Burgess, D. S. Eggleston, S. M. Hwang, K. D. Kopple, P. F. Koster, A. Nichols, C. E. Peishoff, J. M. Samanen, J. A. Vasko, A. Wong, and W. F. Huffman, J. Med. Chem., 35, 3970 (1992). Design and Synthesis of a C7 Mimetic for the Predicted γ-Turn Conformation Found in Several Constrained RGD Antagonists.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 3970
-
-
Callahan, J.F.1
Bean, J.W.2
Burgess, J.L.3
Eggleston, D.S.4
Hwang, S.M.5
Kopple, K.D.6
Koster, P.F.7
Nichols, A.8
Peishoff, C.E.9
Samanen, J.M.10
Vasko, J.A.11
Wong, A.12
Huffman, W.F.13
-
128
-
-
0027495004
-
Direct Design of a Potent Non-Peptide Fibrinogen Receptor Antagonist Based on the Structure and Conformation of a Highly Constrained Cyclic RGD Peptide
-
T. W. Ku, F. E. Ali, L. S. Barton, J. W. Bean, W. E. Bondinell, J. L. Burgess, J. F. Callahan, R. R. Calvo, L. Chen, D. S. Eggleston, J. G. Gleason, W. F. Huffman, S. M. Hwang, D. R. Jakas, C. B. Karash, R. M. Keenan, K. D. Kopple, W. H. Miller, K. A. Newlander, A. Nichols, M. F. Parker, C. E. Peishoff, J. M. Samanen, I. Uzinskas, and J. W. Venslavsky, J. Am. Chem. Soc., 115, 8861 (1994). Direct Design of a Potent Non-Peptide Fibrinogen Receptor Antagonist Based on the Structure and Conformation of a Highly Constrained Cyclic RGD Peptide.
-
(1994)
J. Am. Chem. Soc.
, vol.115
, pp. 8861
-
-
Ku, T.W.1
Ali, F.E.2
Barton, L.S.3
Bean, J.W.4
Bondinell, W.E.5
Burgess, J.L.6
Callahan, J.F.7
Calvo, R.R.8
Chen, L.9
Eggleston, D.S.10
Gleason, J.G.11
Huffman, W.F.12
Hwang, S.M.13
Jakas, D.R.14
Karash, C.B.15
Keenan, R.M.16
Kopple, K.D.17
Miller, W.H.18
Newlander, K.A.19
Nichols, A.20
Parker, M.F.21
Peishoff, C.E.22
Samanen, J.M.23
Uzinskas, I.24
Venslavsky, J.W.25
more..
-
129
-
-
0029013404
-
Potent Nonpeptide Fibrinogen Receptor Antagonists Which Present an Alternative Pharmacophore
-
The reader is referred to continuing work from this group, published after the time period covered by this review. T. W. Ku, W. H. Miller, W. E. Bondinell, K. F. Erhard, R. M. Keenan, A. J. Nichols, C. E. Pieshoff, J. M. Samanen, A. S. Wong, and W. F. Huffman, J. Med. Chem., 38, 9 (1995). Potent Nonpeptide Fibrinogen Receptor Antagonists Which Present an Alternative Pharmacophore.
-
(1995)
J. Med. Chem.
, vol.38
, pp. 9
-
-
Ku, T.W.1
Miller, W.H.2
Bondinell, W.E.3
Erhard, K.F.4
Keenan, R.M.5
Nichols, A.J.6
Pieshoff, C.E.7
Samanen, J.M.8
Wong, A.S.9
Huffman, W.F.10
-
130
-
-
0028048161
-
From Peptide to Non-Peptide. 1. The Elucidation of a Bioactive Conformation of the Arginine-Glycine-Aspartic Acid Recognition Sequence
-
R. S. McDowell, T. R. Gadek, P. L. Barker, D. J. Burkick, K. S. Chan, C. L. Quan, N. Skelton, M. Struble, E. D. Thorsett, M. Tischler, J. Y. K. Tom, T. R. Webb, and J. P. Burnier, J. Am. Chem. Soc., 116, 5069 (1994). From Peptide to Non-Peptide. 1. The Elucidation of a Bioactive Conformation of the Arginine-Glycine-Aspartic Acid Recognition Sequence.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 5069
-
-
McDowell, R.S.1
Gadek, T.R.2
Barker, P.L.3
Burkick, D.J.4
Chan, K.S.5
Quan, C.L.6
Skelton, N.7
Struble, M.8
Thorsett, E.D.9
Tischler, M.10
Tom, J.Y.K.11
Webb, T.R.12
Burnier, J.P.13
-
131
-
-
0027964423
-
From Peptide to Non-Peptide. 2. The de Novo Design of Potent, Non-Peptidal Inhibitors of Platelet Aggregation Based on a Benzodiazepinedione Scaffold
-
R. S. McDowell, B. K. Blackburn, T. R. Gadek, L. R. McGee, T. Rawson, M. E. Reynolds, K. D. Robarge, T. C. Somers, E. D. Thorsett, M. Tischler, R. R. Webb II, and M. C. Venuti, J. Am. Chem. Soc., 116, 5077 (1994). From Peptide to Non-Peptide. 2. The De Novo Design of Potent, Non-Peptidal Inhibitors of Platelet Aggregation Based on a Benzodiazepinedione Scaffold.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 5077
-
-
McDowell, R.S.1
Blackburn, B.K.2
Gadek, T.R.3
McGee, L.R.4
Rawson, T.5
Reynolds, M.E.6
Robarge, K.D.7
Somers, T.C.8
Thorsett, E.D.9
Tischler, M.10
Webb II, R.R.11
Venuti, M.C.12
-
132
-
-
85068953320
-
-
See Reference 124 for a discussion of this methodology in detail
-
See Reference 124 for a discussion of this methodology in detail.
-
-
-
-
133
-
-
85050562346
-
Distance Geometry in Molecular Modeling
-
J. M. Blaney, G. M. Crippen, A. Dearing, and J. S. Dixon, QCPE, Indiana University, Bloomington IN 47405. DGEOM, Program 590 K. B. Lipkowitz and D. B. Boyd, Eds., VCH Publishers, New York
-
J. M. Blaney, G. M. Crippen, A. Dearing, and J. S. Dixon, QCPE, Indiana University, Bloomington IN 47405. DGEOM, Program 590. See also J. M. Blaney and J. S. Dixon, in Reviews in Computational Chemistry, K. B. Lipkowitz and D. B. Boyd, Eds., VCH Publishers, New York, 1994, Vol. 5, pp. 299-335. Distance Geometry in Molecular Modeling.
-
(1994)
Reviews in Computational Chemistry
, vol.5
, pp. 299-335
-
-
Blaney, J.M.1
Dixon, J.S.2
-
134
-
-
0027096411
-
Non-Peptide Fibrinogen Receptor Antagonists. 1. Discovery and Design of Exosite Inhibitors
-
G. D. Hartman, M. S. Egbertson, W. Halczenko, W. L. Laswell, M. E. Duggan, R. L. Smith, A. M. Naylor, P. D. Manno, R. J. Lynch, G. Zhang, C. T.-C. Chang, and R. J. Gould, J. Med. Chem., 35, 4640 (1992). Non-Peptide Fibrinogen Receptor Antagonists. 1. Discovery and Design of Exosite Inhibitors.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 4640
-
-
Hartman, G.D.1
Egbertson, M.S.2
Halczenko, W.3
Laswell, W.L.4
Duggan, M.E.5
Smith, R.L.6
Naylor, A.M.7
Manno, P.D.8
Lynch, R.J.9
Zhang, G.10
Chang, C.T.-C.11
Gould, R.J.12
-
135
-
-
0027053751
-
Potent Inhibitors of Platelet Aggregation Based Upon the Arg-Gly-Asp-Phe Sequence of Fibrinogen. A Proposal on the Nature of the Binding Interactions between the Asp-Carboxylate of RGDX Mimetics and the Platelet GP IIb/IIIa Receptor
-
J. A. Zablocki, M. Miyano, S. N. Rao, S. Panzer-Knodle, N. Nicholson, and L. Feigen, J. Med. Chem., 35, 4914 (1992). Potent Inhibitors of Platelet Aggregation Based Upon the Arg-Gly-Asp-Phe Sequence of Fibrinogen. A Proposal on the Nature of the Binding Interactions Between the Asp-Carboxylate of RGDX Mimetics and the Platelet GP IIb/IIIa Receptor.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 4914
-
-
Zablocki, J.A.1
Miyano, M.2
Rao, S.N.3
Panzer-Knodle, S.4
Nicholson, N.5
Feigen, L.6
-
136
-
-
0027235711
-
Potent in Vitro and in Vivo Inhibitors of Platelet Aggregation Based Upon the Arg-Gly-Asp-Phe Sequence of Fibrinogen. A Proposal on the Nature of the Binding Interactions between the Arg-Guanidine of the RGDX Mimetics and the Platelet GP IIb-IIIa Receptor
-
J. A. Zablocki, M. Miyano, R. B. Garland, D. Pireh, L. Schretzman, S. N. Rao, R. J. Lindmark, S. G. Panzer-Knodle, N. S. Nicholson, B. B. Taite, A. K. Salycrs, L. W. King, J. G. Campion, and L. P. Feigen,J. Med. Chem., 36, 1811 (1993). Potent In Vitro and In Vivo Inhibitors of Platelet Aggregation Based
-
(1993)
J. Med. Chem.
, vol.36
, pp. 1811
-
-
Zablocki, J.A.1
Miyano, M.2
Garland, R.B.3
Pireh, D.4
Schretzman, L.5
Rao, S.N.6
Lindmark, R.J.7
Panzer-Knodle, S.G.8
Nicholson, N.S.9
Taite, B.B.10
Salycrs, A.K.11
King, L.W.12
Campion, J.G.13
Feigen, L.P.14
-
138
-
-
85068947792
-
-
Gaussian, Inc., Pittsburgh, PA 15106
-
Gaussian, Inc., Pittsburgh, PA 15106.
-
-
-
-
139
-
-
0003399528
-
-
Wiley, New York
-
W. J. Hehre, L. Radom, P. v. R. Scheleyer, and J. A. Pople, Ab lnitio Molecular Orbital Theory; Wiley, New York, 1986.
-
(1986)
Ab Lnitio Molecular Orbital Theory
-
-
Hehre, W.J.1
Radom, L.2
Scheleyer, P.V.R.3
Pople, J.A.4
-
140
-
-
0028263876
-
Inhibition of CD4+ T Lymphocyte Binding to Fibronectin and Immune-Cell Accumulation in Inflammatory Sites by Nonpeptide Mimics of Arg-Gly-Asp
-
R. Hershkoviz, N. Greenspoon, Y. A. Mekori, R. Hadari, R. Alon, G. Kapustina, and O. Lider, Clin. Exp. Immunol., 95, 270 (1994). Inhibition of CD4+ T Lymphocyte Binding to Fibronectin and Immune-Cell Accumulation in Inflammatory Sites by Nonpeptide Mimics of Arg-Gly-Asp.
-
(1994)
Clin. Exp. Immunol.
, vol.95
, pp. 270
-
-
Hershkoviz, R.1
Greenspoon, N.2
Mekori, Y.A.3
Hadari, R.4
Alon, R.5
Kapustina, G.6
Lider, O.7
-
141
-
-
0027324834
-
The Versatile Steroid Nucleus: Design and Synthesis of a Peptidomimetic Employing This Novel Scaffold
-
R. Hirschmann, P. A. Sprengeler, T. Kawasaki, J. W. Leahy, W. C. Shakespeare, and A. B. Smith III, Tetrahedron, 49, 3665 (1993). The Versatile Steroid Nucleus: Design and Synthesis of a Peptidomimetic Employing This Novel Scaffold.
-
(1993)
Tetrahedron
, vol.49
, pp. 3665
-
-
Hirschmann, R.1
Sprengeler, P.A.2
Kawasaki, T.3
Leahy, J.W.4
Shakespeare, W.C.5
Smith III, A.B.6
-
142
-
-
84982506235
-
The First Design and Synthesis of a Steroidal Peptidomimetic. The Potential Value of Peptidomimetics in Elucidating the Bioactive Conformation of Peptide Ligands
-
R. Hirschmann, P. A. Sprengeler, T. Kawasaki, J. W. Leahy, W. C. Shakespeare, and A. B. Smith III,J. Am. Chem. Soc. 114, 9699 (1992). The First Design and Synthesis of a Steroidal Peptidomimetic. The Potential Value of Peptidomimetics in Elucidating the Bioactive Conformation of Peptide Ligands.
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 9699
-
-
Hirschmann, R.1
Sprengeler, P.A.2
Kawasaki, T.3
Leahy, J.W.4
Shakespeare, W.C.5
Smith III, A.B.6
-
143
-
-
0026599016
-
Peptide Mimetics of the Thrombin-Bound Structure of Fibrinopeptide A
-
H. Nakanishi, R. A. Chrusciel, R. Shen, S. Bertenshaw, M. E. Johnson, T. J. Rydel, A. Tulinsky, and M. Kahn, Proc. Natl. Acad. Sci. U.S.A., 89, 1705 (1992). Peptide Mimetics of the Thrombin-Bound Structure of Fibrinopeptide A.
-
(1992)
Proc. Natl. Acad. Sci. U.S.A.
, vol.89
, pp. 1705
-
-
Nakanishi, H.1
Chrusciel, R.A.2
Shen, R.3
Bertenshaw, S.4
Johnson, M.E.5
Rydel, T.J.6
Tulinsky, A.7
Kahn, M.8
-
144
-
-
0025329390
-
The Structure of a Complex of Recombinant Hirudin and Human Alpha-Thrombin
-
T. J. Rydel, K. G. Ravichandran, A. Tulinsky, W. Bode, R. Huber, C. Roitsch, and J. W. Fenton II, Science, 249, 277 (1990). The Structure of a Complex of Recombinant Hirudin and Human Alpha-Thrombin.
-
(1990)
Science
, vol.249
, pp. 277
-
-
Rydel, T.J.1
Ravichandran, K.G.2
Tulinsky, A.3
Bode, W.4
Huber, R.5
Roitsch, C.6
Fenton II, J.W.7
-
145
-
-
33947092515
-
Structural Basis of Activation and Action of Trypsin
-
R. Huber, and W. Bode, Acc. Chem. Res., 111 (1978). Structural Basis of Activation and Action of Trypsin. See also references therein.
-
(1978)
Acc. Chem. Res.
, pp. 111
-
-
Huber, R.1
Bode, W.2
-
146
-
-
0027296565
-
The Structure of a Designed Peptidomimetic Inhibitor Complex of α-Thrombin
-
T.-P. Wu, V. Yee, A. Tulinsky, R. A. Chrusciel, H. Nakanishi, R. Shen, C. Priebe, and M. Kahn, Protein Eng., 6, 471 (1993). The Structure of a Designed Peptidomimetic Inhibitor Complex of α-Thrombin.
-
(1993)
Protein Eng.
, vol.6
, pp. 471
-
-
Wu, T.-P.1
Yee, V.2
Tulinsky, A.3
Chrusciel, R.A.4
Nakanishi, H.5
Shen, R.6
Priebe, C.7
Kahn, M.8
-
147
-
-
0028263518
-
1,3-Diarylindan-2-carboxylic Acids, Potent and Selective Non-Peptide Endothelin Receptor Antagonists
-
J. D. Elliott, M. A. Lago, R. D. Cousins, A. Gao, J. D. Leber, K. F. Erhard, P. Nambi, N. A. Elshourbagy, C. Kumar, J. A. Lee, J. W. Bean, C. W. DeBrosse, D. S. Eggleston, D. P. Brooks, G. Feuerstein, R. R. Ruffolo Jr., J. Weinstock, J. G. Gleason, C. E. Peishoff, and E. H. Ohlstein, J. Med. Chem., 37, 1553 (1994). 1,3-Diarylindan-2-carboxylic Acids, Potent and Selective Non-Peptide Endothelin Receptor Antagonists.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 1553
-
-
Elliott, J.D.1
Lago, M.A.2
Cousins, R.D.3
Gao, A.4
Leber, J.D.5
Erhard, K.F.6
Nambi, P.7
Elshourbagy, N.A.8
Kumar, C.9
Lee, J.A.10
Bean, J.W.11
DeBrosse, C.W.12
Eggleston, D.S.13
Brooks, D.P.14
Feuerstein, G.15
Ruffolo Jr., R.R.16
Weinstock, J.17
Gleason, J.G.18
Peishoff, C.E.19
Ohlstein, E.H.20
more..
-
148
-
-
0028093424
-
SB 209670, a Rationally Designed Potent Nonpeptide Endothelin Receptor Antagonist
-
E. H. Ohlstein, P. Nambi, S. A. Douglas, R. M. Edwards, M. Gellai, A. Lago, J. D. Leber, R. D. Cousins, A. Gao, J. S. Frazee, C. E. Peishorf, J. W. Bean, D. S. Eggleston, N. A. EIshourbagy, C. Kumar, J. A. Lee, T.-L. Yue, C. Louden, D. P. Brooks, J. Weinstock, G. Feuerstein, G. Poste, R. R. Ruffolo Jr., J. G. Gleason, and J. D. Elliott, Froc. Natl. Acad. Sci. U.S.A., 91, 8052 (1994). SB 209670, A Rationally Designed Potent Nonpeptide Endothelin Receptor Antagonist.
-
(1994)
Froc. Natl. Acad. Sci. U.S.A.
, vol.91
, pp. 8052
-
-
Ohlstein, E.H.1
Nambi, P.2
Douglas, S.A.3
Edwards, R.M.4
Gellai, M.5
Lago, A.6
Leber, J.D.7
Cousins, R.D.8
Gao, A.9
Frazee, J.S.10
Peishorf, C.E.11
Bean, J.W.12
Eggleston, D.S.13
Eishourbagy, N.A.14
Kumar, C.15
Lee, J.A.16
Yue, T.-L.17
Louden, C.18
Brooks, D.P.19
Weinstock, J.20
Feuerstein, G.21
Poste, G.22
Ruffolo Jr., R.R.23
Gleason, J.G.24
Elliott, J.D.25
more..
-
149
-
-
85068954402
-
-
Details are to be published
-
Details are to be published.
-
-
-
-
150
-
-
0026593030
-
Biological Profiles of Highly Potent Novel Endothelin Antagonists Selective for the ETA Receptor
-
M. Ihara, K. Noguchi, T. Saeki, T. Fukuroda, S. Tsuchida, S. Kimura, T. Fukami, K. Ishikawa, M. Nishikibe, and M. Yano, Life. Sci., 50, 247 (1992). Biological Profiles of Highly Potent Novel Endothelin Antagonists Selective for the ETA Receptor.
-
(1992)
Life. Sci.
, vol.50
, pp. 247
-
-
Ihara, M.1
Noguchi, K.2
Saeki, T.3
Fukuroda, T.4
Tsuchida, S.5
Kimura, S.6
Fukami, T.7
Ishikawa, K.8
Nishikibe, M.9
Yano, M.10
-
151
-
-
0028064679
-
Conformations of Cyclic Pentapeptide Endothelin Receptor Antagonists
-
J. W. Bean, C. E. Peishoff, and K. D. Kopple, Int. J. Peptide Protein Res., 44, 223 (1994). Conformations of Cyclic Pentapeptide Endothelin Receptor Antagonists.
-
(1994)
Int. J. Peptide Protein Res.
, vol.44
, pp. 223
-
-
Bean, J.W.1
Peishoff, C.E.2
Kopple, K.D.3
-
152
-
-
0037541976
-
Side Chain Conformation of Somatostatin Analogs when Bound to Receptors
-
S. Reichlin, Ed., Plenum Press, New York
-
R. F. Nutt, C. D. Colton, R. Saperstein, and D. F. Veber, in Somatostatin, S. Reichlin, Ed., Plenum Press, New York, 1987, pp. 83-88. Side Chain Conformation of Somatostatin Analogs when Bound to Receptors.
-
(1987)
Somatostatin
, pp. 83-88
-
-
Nutt, R.F.1
Colton, C.D.2
Saperstein, R.3
Veber, D.F.4
-
153
-
-
0026470597
-
Nonpeptidal Peptidomimetics with a β-D-Glucose Scaffolding. A Partial Somatostatin Agonist Bearing a Close Structural Relationship to a Potent, Selective Substance P Antagonist
-
R. Hirschmann, K. C. Nicolaou, S. Pietranico, J. Salvino, E. M. Leahy, P. A. Sprengeler, G. Fürst, A. B. Smith III, C. D. Strader, M. A. Cascieri, M. R. Candelore, C. Donaldson, W. Vale, and L. Maechler,J. Am. Chem. Soc., 114, 9217 (1992). Nonpeptidal Peptidomimetics with a β-D-Glucose Scaffolding. A Partial Somatostatin Agonist Bearing a Close Structural Relationship to a Potent, Selective Substance P Antagonist.
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 9217
-
-
Hirschmann, R.1
Nicolaou, K.C.2
Pietranico, S.3
Salvino, J.4
Leahy, E.M.5
Sprengeler, P.A.6
Fürst, G.7
Smith III, A.B.8
Strader, C.D.9
Cascieri, M.A.10
Candelore, M.R.11
Donaldson, C.12
Vale, W.13
Maechler, L.14
-
154
-
-
0027857964
-
De Novo Design and Synthesis of Somatostatin Non-Peptide Peptidomimetics Utilizing β-D-Glucose as a Novel Scaffolding
-
R. Hirschmann, K. C. Nicolaou, S. Pietranico, E. M. Leahy, J. Salvino, B. Arison, M. A. Cichy, P. G. Spoors, W. C. Shakespeare, P. A. Sprengeler, P. Hamley, A. B. Smith III, T. Reisine, K. Raynor, L. Maechler, C. Donaldson, W. Vale, R. M. Freidinger, M. A. Cascieri, and C. D. Strader,J. Am. Chem. Soc., 115, 12550 (1993). De Novo Design and Synthesis of Somatostatin Non-Peptide Peptidomimetics Utilizing β-D-Glucose as a Novel Scaffolding.
-
(1993)
J. Am. Chem. Soc.
, vol.115
, pp. 12550
-
-
Hirschmann, R.1
Nicolaou, K.C.2
Pietranico, S.3
Leahy, E.M.4
Salvino, J.5
Arison, B.6
Cichy, M.A.7
Spoors, P.G.8
Shakespeare, W.C.9
Sprengeler, P.A.10
Hamley, P.11
Smith III, A.B.12
Reisine, T.13
Raynor, K.14
Maechler, L.15
Donaldson, C.16
Vale, W.17
Freidinger, R.M.18
Cascieri, M.A.19
Strader, C.D.20
more..
-
155
-
-
0026774922
-
Design, Synthesis, and Binding Affinity of a Nonpeptide Mimic of Somatostatin
-
C. Papageorgiou, R. Haltiner, C. Burns, and T. J. Petcher, Bioorg. Med. Chem. Lett., 2, 135 (1992). Design, Synthesis, and Binding Affinity of a Nonpeptide Mimic of Somatostatin.
-
(1992)
Bioorg. Med. Chem. Lett.
, vol.2
, pp. 135
-
-
Papageorgiou, C.1
Haltiner, R.2
Burns, C.3
Petcher, T.J.4
-
156
-
-
5944250450
-
Energy Parameters in Polypeptides. VII. Geometric Parameters, Partial Atomic Charges, Nonbonded Interactions, Hydrogen Bond Interactions, and Intrinsic Torsional Potentials for the Naturally Occurring Amino Acids
-
F. Momany, R. F. McGuire, A. W. Burgess, and H. A. Scheraga,J. Phys. Chem., 79, 2361 (1975). Energy Parameters in Polypeptides. VII. Geometric Parameters, Partial Atomic Charges, Nonbonded Interactions, Hydrogen Bond Interactions, and Intrinsic Torsional Potentials for the Naturally Occurring Amino Acids.
-
(1975)
J. Phys. Chem.
, vol.79
, pp. 2361
-
-
Momany, F.1
McGuire, R.F.2
Burgess, A.W.3
Scheraga, H.A.4
-
157
-
-
2142712244
-
-
QCPE, Bloomington, IN
-
See also M. J. Browman, L. M. Carruthers, K. L. Kashuba, F. A. Momany, M. S. Pottle, S. P. Rosen, S. M. Rumsey, G. F. Endres, and H. A. Scheraga, QCPE, 11, 286 (1975); QCPE, Bloomington, IN.
-
(1975)
QCPE
, vol.11
, pp. 286
-
-
Browman, M.J.1
Carruthers, L.M.2
Kashuba, K.L.3
Momany, F.A.4
Pottle, M.S.5
Rosen, S.P.6
Rumsey, S.M.7
Endres, G.F.8
Scheraga, H.A.9
-
159
-
-
0028294987
-
A Novel 3-Substituted Benzazepinone Growth Hormone Secretagogue (L-692,429)
-
W. R. Schoen, J. M. Pisano, K. Prendergast, M. J. Wyvratt Jr., M. H. Fisher, K. Cheng, W. W.-S. Chan, B. Butler, R. G. Smith, and R. G. Ball, J. Med. Chem., 37, 897 (1994). A Novel 3-Substituted Benzazepinone Growth Hormone Secretagogue (L-692,429).
-
(1994)
J. Med. Chem.
, vol.37
, pp. 897
-
-
Schoen, W.R.1
Pisano, J.M.2
Prendergast, K.3
Wyvratt Jr., M.J.4
Fisher, M.H.5
Cheng, K.6
Chan, W.W.-S.7
Butler, B.8
Smith, R.G.9
Ball, R.G.10
-
160
-
-
85068953720
-
-
Molecular Simulations, Inc., San Diego, CA
-
Molecular Simulations, Inc., San Diego, CA.
-
-
-
-
161
-
-
84986512474
-
CHARMM: A Program for Macromolecular Energy Minimization and Dynamics Calculations
-
B. R. Brooks, R. E. Bruccoleri, B. D. Olafson, D. J. States, S. Swaminathan, and M. Karplus, J. Compttt. Chem., 4, 187 (1983). CHARMM: A Program for Macromolecular Energy Minimization and Dynamics Calculations.
-
(1983)
J. Compttt. Chem.
, vol.4
, pp. 187
-
-
Brooks, B.R.1
Bruccoleri, R.E.2
Olafson, B.D.3
States, D.J.4
Swaminathan, S.5
Karplus, M.6
-
162
-
-
44949267284
-
An Alternative Method for the Alignment of Molecular Structures: Maximizing Electrostatic and Steric Overlap
-
S. Kearsley and G. Smith, Tetrahedron Compttt. Methodol., 3, 615 (1992). An Alternative Method for the Alignment of Molecular Structures: Maximizing Electrostatic and Steric Overlap.
-
(1992)
Tetrahedron Compttt. Methodol.
, vol.3
, pp. 615
-
-
Kearsley, S.1
Smith, G.2
-
163
-
-
0026498297
-
Development of a Novel Class of Cyclic Hexapeptide Oxytocin Antagonists Based on a Natural Product
-
P. D. Williams, M. G. Bock, R. D. Tung, V. M. Garsky, D. S. Perlow, J. M. Erb, G. F. Lundell, N. P. Could, W. L. Whitter, J. B. Hoffman, M. J. Kaufman, B. V. Clineschmidt, D. J. Pettibone, R. M. Freidinger, and D. F. Veber,J. Med. Chem. 35, 3905 (1992). Development of a Novel Class of Cyclic Hexapeptide Oxytocin Antagonists Based on a Natural Product.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 3905
-
-
Williams, P.D.1
Bock, M.G.2
Tung, R.D.3
Garsky, V.M.4
Perlow, D.S.5
Erb, J.M.6
Lundell, G.F.7
Could, N.P.8
Whitter, W.L.9
Hoffman, J.B.10
Kaufman, M.J.11
Clineschmidt, B.V.12
Pettibone, D.J.13
Freidinger, R.M.14
Veber, D.F.15
-
164
-
-
0028324477
-
1-(((7,7-Dimethyl-2(S)-2(S)-amino-4-(methylsulfonyl)butyramido)bicyclo[2 . 2.1]-heptan-1(S)-yl)methyl)sulfonyl-4-(2-methylphenyl)piperazine (L-3 68,899): An Orally Bioavailable, Non-Peptide Oxytocin Antagonist with Potential Utility for Managing Preterm Labor
-
P. D. Williams, P. S. Anderson, R. G. Ball, M. G. Bock, L. Carroll, S.-H. L. Chiu, B. V. Clineschmidt, J. C. Culberson, J. M. Erb, B. E. Evans, S. L. Fitzpatrick, R. M. Freidinger, M. J. Kaufman, G. F. Lundell, J. S. Murphy, J. M. Pawluczyk, D. S. Perlow, D. J. Pettibone, S. M. Pitzenberger, K. L. Thompson, and D. F. Veber, J. Med. Chem., 37, 565 (1994). 1-(((7,7-Dimethyl-2(S)-2(S)-amino-4-(methylsulfonyl)butyramido)bicyclo[2.2.1]- heptan-1(S)-yl)methyl)sulfonyl)-4-(2-methylphenyl)piperazine (L-3 68,899): An Orally Bioavailable, Non-Peptide Oxytocin Antagonist with Potential Utility for Managing Preterm Labor.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 565
-
-
Williams, P.D.1
Anderson, P.S.2
Ball, R.G.3
Bock, M.G.4
Carroll, L.5
Chiu, S.-H.L.6
Clineschmidt, B.V.7
Culberson, J.C.8
Erb, J.M.9
Evans, B.E.10
Fitzpatrick, S.L.11
Freidinger, R.M.12
Kaufman, M.J.13
Lundell, G.F.14
Murphy, J.S.15
Pawluczyk, J.M.16
Perlow, D.S.17
Pettibone, D.J.18
Pitzenberger, S.M.19
Thompson, K.L.20
Veber, D.F.21
more..
-
165
-
-
0037571112
-
Merck Molecular Force Field. I. Basis, Form, Scope, Parameterization, and Performance of MMFF94
-
T. A. Halgren, J. Comput. Chem., 17, 490 (1996). Merck Molecular Force Field. I. Basis, Form, Scope, Parameterization, and Performance of MMFF94. See also following papers of series.
-
(1996)
J. Comput. Chem.
, vol.17
, pp. 490
-
-
Halgren, T.A.1
-
166
-
-
85068948278
-
-
SQUEAL (Structural and Qualitative Electrostatic ALignment) is an unpublished variation of SEAL. M. D. Miller, Merck Research Laboratories, West Point, PA
-
SQUEAL (Structural and Qualitative Electrostatic ALignment) is an unpublished variation of SEAL. M. D. Miller, Merck Research Laboratories, West Point, PA.
-
-
-
-
167
-
-
0021326036
-
Neurotensin Stimulates Formation of Cyclic-GMP in Murine Neuro-Balstoma Clone N1E-115
-
J. A. Gilbert and E. Richelson, Eur. J. Pharmacol., 99, 245 (1984). Neurotensin Stimulates Formation of Cyclic-GMP in Murine Neuro-Balstoma Clone N1E-115.
-
(1984)
Eur. J. Pharmacol.
, vol.99
, pp. 245
-
-
Gilbert, J.A.1
Richelson, E.2
-
168
-
-
0028493021
-
Rational Design of Novel Neurotensin Mimetics: Discovery of a Pharmacologically Unprecedented Agent Exhibiting Concentration-Dependent Dual Effects as Antagonist and Full Agonist
-
Y.-P. Pang, J. Zaidi, A. P. Kozikowski. B. Cusack, and E. Richelson, J. Comput. Aided Mol. Design, 8, 433 (1994). Rational Design of Novel Neurotensin Mimetics: Discovery of a Pharmacologically Unprecedented Agent Exhibiting Concentration-Dependent Dual Effects as Antagonist and Full Agonist.
-
(1994)
J. Comput. Aided Mol. Design
, vol.8
, pp. 433
-
-
Pang, Y.-P.1
Zaidi, J.2
Kozikowski, A.P.3
Cusack, B.4
Richelson, E.5
-
169
-
-
0001911108
-
Opioid Receptors
-
J. C. Emmett, Eds., Pergamon Press, New York
-
D. C. Rees and J. C. Hunter, in Comprehensive Medicinal Chemistry. The Rational Design, Mechanistic Study & Therapeutic Application of Chemical Compounds, Membranes & Receptors, J. C. Emmett, Eds., Pergamon Press, New York, 1990, Vol. 3, pp. 805-846. Opioid Receptors.
-
(1990)
Comprehensive Medicinal Chemistry. The Rational Design, Mechanistic Study & Therapeutic Application of Chemical Compounds, Membranes & Receptors
, vol.3
, pp. 805-846
-
-
Rees, D.C.1
Hunter, J.C.2
-
170
-
-
0027287525
-
Nonpeptide β-Turn Mimetics of Enkephalin
-
T. Su, H. Nakanishi, L. Xue, B. Chen, S. Tuladhar, M. E. Johnson, and M. Kahn, Bioorg. Med. Chem. Lett., 3, 835 (1993). Nonpeptide β-Turn Mimetics of Enkephalin.
-
(1993)
Bioorg. Med. Chem. Lett.
, vol.3
, pp. 835
-
-
Su, T.1
Nakanishi, H.2
Xue, L.3
Chen, B.4
Tuladhar, S.5
Johnson, M.E.6
Kahn, M.7
-
171
-
-
0025974617
-
Simulation of the Structure and Dynamics of the Bis(penicillamine) Enkephalin Zwitterion
-
P. E. Smith, L. X. Dang, and B. M. Pettitt, J. Am. Chem. Soc., 113, 67 (1991). Simulation of the Structure and Dynamics of the Bis(penicillamine) Enkephalin Zwitterion.
-
(1991)
J. Am. Chem. Soc.
, vol.113
, pp. 67
-
-
Smith, P.E.1
Dang, L.X.2
Pettitt, B.M.3
-
172
-
-
0027158693
-
Conformationally Constrained Nonpeptide β-Turn Mimetics of Enkephalin
-
B. Gardner, H. Nakanishi, and M. Kahn, Tetrahedron, 49, 3433 (1993). Conformationally Constrained Nonpeptide β-Turn Mimetics of Enkephalin.
-
(1993)
Tetrahedron
, vol.49
, pp. 3433
-
-
Gardner, B.1
Nakanishi, H.2
Kahn, M.3
-
173
-
-
0027232860
-
Design and Synthesis of a Bicyclic Non-Peptide β-Bend Mimetic of Enkephalin
-
B. L. Currie, J. L. Krstenansky, Z.-L. Lin, J. Ungwitayatorn, Y.-H. Lee, M. del Rosario-Chow, W.-S. Sheu, and M. E. Johnson, Tetrahedron, 49, 3489 (1993). Design and Synthesis of a Bicyclic Non-Peptide β-Bend Mimetic of Enkephalin.
-
(1993)
Tetrahedron
, vol.49
, pp. 3489
-
-
Currie, B.L.1
Krstenansky, J.L.2
Lin, Z.-L.3
Ungwitayatorn, J.4
Lee, Y.-H.5
Del Rosario-Chow, M.6
Sheu, W.-S.7
Johnson, M.E.8
-
176
-
-
0000782536
-
A New Approach to Probing Conformational Space with Molecular Mechanics: Random Incremental Pulse Search
-
D. M. Ferguson and D. J. Raber,J. Am. Chem. Soc., 111,4371 (1989). A New Approach to Probing Conformational Space with Molecular Mechanics: Random Incremental Pulse Search.
-
(1989)
J. Am. Chem. Soc.
, vol.111
, pp. 4371
-
-
Ferguson, D.M.1
Raber, D.J.2
-
177
-
-
84988120944
-
Molecular Mechanics Conformational Analysis of Cyclononane using the RIPS Method and Comparison with Quantum-Mechanical Calculations
-
D. M. Ferguson, W. A. Glauser, and D. J. Raber, J. Comput. Chem., 10, 903 (1989). Molecular Mechanics Conformational Analysis of Cyclononane using the RIPS Method and Comparison with Quantum-Mechanical Calculations.
-
(1989)
J. Comput. Chem.
, vol.10
, pp. 903
-
-
Ferguson, D.M.1
Glauser, W.A.2
Raber, D.J.3
-
180
-
-
0024418444
-
-
Thyrotropin Releasing Hormone: Biomedical Significance, G. Metcalf, and I. M. D. Jackson, Eds., New York
-
See, for example, M. Miyamoto, N. Yamazaki, A. Nagaoka, and Y. Nigawa, in Thyrotropin Releasing Hormone: Biomedical Significance, G. Metcalf, and I. M. D. Jackson, Eds., Annals of the New York Academy of Science, New York, pp. 508 ff., 1989.
-
(1989)
Annals of the New York Academy of Science
-
-
Miyamoto, M.1
Yamazaki, N.2
Nagaoka, A.3
Nigawa, Y.4
-
181
-
-
37049107472
-
Molecular Conformation of Thyrotropin Releasing Hormone from the X-Ray Analysis of its Tartrate
-
K. Kamiya, M. Takamoto, Y. Wada, M. Fujino, and M. Nishikawa, J. Chem. Soc. Chem. Commun., 438 (1980). Molecular Conformation of Thyrotropin Releasing Hormone from the X-Ray Analysis of its Tartrate.
-
(1980)
J. Chem. Soc. Chem. Commun.
, pp. 438
-
-
Kamiya, K.1
Takamoto, M.2
Wada, Y.3
Fujino, M.4
Nishikawa, M.5
-
182
-
-
84886614348
-
Two Conformations of TRH in Solution
-
J. Vicar, E. Abillon, F. Toma, F. Piriou, K. Lintner, K. Blaha, P. Fromageot, and S. Fermandjian, FEBS Lett., 97, 275 (1979). Two Conformations of TRH in Solution.
-
(1979)
FEBS Lett.
, vol.97
, pp. 275
-
-
Vicar, J.1
Abillon, E.2
Toma, F.3
Piriou, F.4
Lintner, K.5
Blaha, K.6
Fromageot, P.7
Fermandjian, S.8
-
183
-
-
0003118187
-
-
Ph.D. Thesis, Washington University, St. Louis, MO
-
M. L. Moore, Ph.D. Thesis, Washington University, St. Louis, MO, 1978, p. 23. Probing the Thyroliberin Receptor.
-
(1978)
Probing the Thyroliberin Receptor
, pp. 23
-
-
Moore, M.L.1
-
185
-
-
0029102387
-
Peptide Mimetics of Thyrotropin-Releasing Hormone Based on a Cyclohexane Framework: Design, Synthesis, and Cognition-Enhancing Properties
-
G. L. Oison, H.-C. Cheung, E. Chiang, V. S. Madison, J. Sepinwall, G. P. Vincent, A. Winokur, and K. A. Gary, J. Med. Chem., 38, 2866 (1995). Peptide Mimetics of Thyrotropin-Releasing Hormone Based on a Cyclohexane Framework: Design, Synthesis, and Cognition-Enhancing Properties.
-
(1995)
J. Med. Chem.
, vol.38
, pp. 2866
-
-
Oison, G.L.1
Cheung, H.-C.2
Chiang, E.3
Madison, V.S.4
Sepinwall, J.5
Vincent, G.P.6
Winokur, A.7
Gary, K.A.8
-
186
-
-
0011106389
-
Tachykinin Receptors
-
Pergamon Press, New York
-
A. S. Dutta, in Comprehensive Medicinal Chemistry. The Rational Design, Mechanistic Study & Therapeutic Application of Chemical Compounds, Vol. 3, Membranes & Receptors, Pergamon Press, New York, 1990, pp. 1001-1022. Tachykinin Receptors.
-
(1990)
Comprehensive Medicinal Chemistry. The Rational Design, Mechanistic Study & Therapeutic Application of Chemical Compounds, Vol. 3, Membranes & Receptors
, vol.3
, pp. 1001-1022
-
-
Dutta, A.S.1
-
188
-
-
0024318318
-
Neuropeptides and Inflammation: The Role of Substance P
-
D. G. Payan, Annu. Rev. Med. Chem., 40, 341 (1989). Neuropeptides and Inflammation: The Role of Substance P.
-
(1989)
Annu. Rev. Med. Chem.
, vol.40
, pp. 341
-
-
Payan, D.G.1
-
189
-
-
0026153696
-
Toward Nonpeptidal Substance P Mimetic Analogues: Design, Synthesis, and Biological Activity
-
M. Chorev, E. Roubini, C. Gilon, and Z. Selinger, Biopolymers, 31, 725 (1991). Toward Nonpeptidal Substance P Mimetic Analogues: Design, Synthesis, and Biological Activity.
-
(1991)
Biopolymers
, vol.31
, pp. 725
-
-
Chorev, M.1
Roubini, E.2
Gilon, C.3
Selinger, Z.4
-
190
-
-
0026695818
-
The Discovery of (2S,3S)-cis-2-Diphenylmethyl-N-[(2-methoxyphenyl)methyl]-l-azabicyclo[2.2.2]- octan-3-amine as a Novel, Nonpeptide Substance P Antagonist
-
See, for example, J. A. Lowe III, S. E. Drozda, R. M. Snider, D. P. Longo, S. H. Zorn, J. Morrone, E. R. Jackson, S. McLean, D. K. Bryce, J. Broder, A. Nagahisa, Y. Kanai, O. Suga, and M. Tsuchiya,J. Med. Chem., 35, 2591 (1992). The Discovery of (2S,3S)-cis-2-Diphenylmethyl-N-[(2-methoxyphenyl)methyl]-l-azabicyclo[2.2.2]- octan-3-amine as a Novel, Nonpeptide Substance P Antagonist.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 2591
-
-
Lowe III, J.A.1
Drozda, S.E.2
Snider, R.M.3
Longo, D.P.4
Zorn, S.H.5
Morrone, J.6
Jackson, E.R.7
McLean, S.8
Bryce, D.K.9
Broder, J.10
Nagahisa, A.11
Kanai, Y.12
Suga, O.13
Tsuchiya, M.14
-
191
-
-
0027300608
-
Design, Synthesis and Three-Dimensional Structural Characterization of a Constrained Ω-Loop Excised from Interleukin 1α
-
R. Sarabu, K. Lovey, V. S. Madison, D. C. Fry, D. N. Greeley, C. M. Cook, and G. L. Olson, Tetrahedron, 49, 3629 (1993). Design, Synthesis and Three-Dimensional Structural Characterization of a Constrained Ω-Loop Excised from Interleukin 1α.
-
(1993)
Tetrahedron
, vol.49
, pp. 3629
-
-
Sarabu, R.1
Lovey, K.2
Madison, V.S.3
Fry, D.C.4
Greeley, D.N.5
Cook, C.M.6
Olson, G.L.7
-
192
-
-
0025274045
-
Structure of Interleukin 1α at 2.7 Å Resolution
-
B. Graves, H. M. Hatada, W. A. Hendrickson, J. K. Miller, V. S. Madison, and Y. Satow, Biochemistry, 29, 2679 (1990). Structure of Interleukin 1α at 2.7 Å Resolution.
-
(1990)
Biochemistry
, vol.29
, pp. 2679
-
-
Graves, B.1
Hatada, H.M.2
Hendrickson, W.A.3
Miller, J.K.4
Madison, V.S.5
Satow, Y.6
-
194
-
-
0026802182
-
Design, Synthesis and Conformational Analysis of γ-Turn Peptide Mimetics of Bradykinin
-
M. Sato, J. Y. H. Lee, H. Nakanishi, M. E. Johnson, R. A. Chrusciel, and M. Kahn, Biochem. Biophys. Res. Commun., 187, 999 (1992). Design, Synthesis and Conformational Analysis of γ-Turn Peptide Mimetics of Bradykinin.
-
(1992)
Biochem. Biophys. Res. Commun.
, vol.187
, pp. 999
-
-
Sato, M.1
Lee, J.Y.H.2
Nakanishi, H.3
Johnson, M.E.4
Chrusciel, R.A.5
Kahn, M.6
-
195
-
-
0000762297
-
Crystal Structure and Conformation of cyclo-(Glycylprolylglycyl-D-alanylprolyl) Containing 4 → 1 and 3 → 1 Intramolecular Hydrogen Bonds
-
I. L. Karle, J. Am. Chem. Soc., 100, 1286 (1978). Crystal Structure and Conformation of cyclo-(Glycylprolylglycyl-D-alanylprolyl) Containing 4 → 1 and 3 → 1 Intramolecular Hydrogen Bonds.
-
(1978)
J. Am. Chem. Soc.
, vol.100
, pp. 1286
-
-
Karle, I.L.1
-
196
-
-
0027220896
-
Design of Potent Non-Peptide Competitive Antagonists of the Human Bradykinin B, Receptor
-
J. M. Salvino, P. R. Seoane, B. D. Douty, M. M. A. Awad, R. E. Dolle, W. T. Houck, D. M. Faunce, and D. G. Sawutz, J. Med. Chem., 36, 2583 (1993). Design of Potent Non-Peptide Competitive Antagonists of the Human Bradykinin B, Receptor.
-
(1993)
J. Med. Chem.
, vol.36
, pp. 2583
-
-
Salvino, J.M.1
Seoane, P.R.2
Douty, B.D.3
Awad, M.M.A.4
Dolle, R.E.5
Houck, W.T.6
Faunce, D.M.7
Sawutz, D.G.8
-
197
-
-
0028229872
-
2 Receptor Antagonist
-
2 Receptor Antagonist.
-
(1994)
Proc. Natl. Acad. Sci. U.S.A.
, vol.91
, pp. 4693
-
-
Sawutz, D.G.1
Salvino, J.M.2
Dolle, R.E.3
Casiano, F.4
Ward, S.J.5
Houck, W.T.6
Faunce, D.M.7
Douty, B.D.8
Baizman, E.9
Awad, M.M.A.10
Marceau, F.11
Seoane, P.R.12
-
198
-
-
0000603111
-
Conformational Analysis of Bradykinin by Annealed Molecular Dynamics and Comparison to NMR Derived Conformations
-
J. M. Salvino, P. R. Seoane, and R. E. Dolle,J. Comput. Chem., 14, 438 (1993). Conformational Analysis of Bradykinin by Annealed Molecular Dynamics and Comparison to NMR Derived Conformations.
-
(1993)
J. Comput. Chem.
, vol.14
, pp. 438
-
-
Salvino, J.M.1
Seoane, P.R.2
Dolle, R.E.3
-
199
-
-
0025951223
-
Probing the Bradykinin Receptor: Mapping the Geometric Topography Using Ethers of Hydroxyproline in Novel Peptides
-
D. J. Kyle, J. A. Martin, R. M. Burch, J. P. Carter, S. Lu, S. Meeker, J. C. Prosser, J. P. Sullivan, J. Togo, L. Noronha-Blob, J. A. Sinsko, R. F. Walters, L. W. Whaley, and R. N. Hiner, J. Med. Chem., 34, 2649 (1991). Probing the Bradykinin Receptor: Mapping the Geometric Topography Using Ethers of Hydroxyproline in Novel Peptides.
-
(1991)
J. Med. Chem.
, vol.34
, pp. 2649
-
-
Kyle, D.J.1
Martin, J.A.2
Burch, R.M.3
Carter, J.P.4
Lu, S.5
Meeker, S.6
Prosser, J.C.7
Sullivan, J.P.8
Togo, J.9
Noronha-Blob, L.10
Sinsko, J.A.11
Walters, R.F.12
Whaley, L.W.13
Hiner, R.N.14
-
200
-
-
0025845088
-
Design and Conformational Analysis of Several Highly Potent Bradykinin Receptor Antagonists
-
D. J. Kyle, J. A. Martin, S. G. Farmer, and R. M. Burch, J. Med. Chein., 34, 1230 (1991). Design and Conformational Analysis of Several Highly Potent Bradykinin Receptor Antagonists.
-
(1991)
J. Med. Chein.
, vol.34
, pp. 1230
-
-
Kyle, D.J.1
Martin, J.A.2
Farmer, S.G.3
Burch, R.M.4
-
201
-
-
0026897295
-
A Novel β-Turn Mimic Useful for Mapping the Unknown Topology of Peptide Receptors
-
D. J. Kyle, L. M. Green, P. R. Blake, D. Smithwick, and M. F. Summers, Peptide Res., 5, 206 (1992). A Novel β-Turn Mimic Useful for Mapping the Unknown Topology of Peptide Receptors.
-
(1992)
Peptide Res.
, vol.5
, pp. 206
-
-
Kyle, D.J.1
Green, L.M.2
Blake, P.R.3
Smithwick, D.4
Summers, M.F.5
-
202
-
-
0025850422
-
Design and Synthesis of a Mimetic from an Antibody Complementarity-Determining Region
-
H. U. Saragovi, D. Fitzpatrick, A. Raktabutr, H. Nakanishi, M. Kahn, and M. I. Greene, Science, 253, 792 (1991). Design and Synthesis of a Mimetic from an Antibody Complementarity-Determining Region.
-
(1991)
Science
, vol.253
, pp. 792
-
-
Saragovi, H.U.1
Fitzpatrick, D.2
Raktabutr, A.3
Nakanishi, H.4
Kahn, M.5
Greene, M.I.6
-
203
-
-
0026781840
-
Refined Crystal Structure of the Influenza Virus N9 Neuraminidase-NC41 Fab Complex
-
W. R. Tulip, J. N. Varghese, W. G. Laver, R. G. Webster, and P. M. Colman, J. Mol. Biol., 227, 122 (1992). Refined Crystal Structure of the Influenza Virus N9 Neuraminidase-NC41 Fab Complex.
-
(1992)
J. Mol. Biol.
, vol.227
, pp. 122
-
-
Tulip, W.R.1
Varghese, J.N.2
Laver, W.G.3
Webster, R.G.4
Colman, P.M.5
-
204
-
-
0028236239
-
Design and Synthesis of a Biologically Active Antibody Mimic Based on an Antibody-Antigen Crystal Structure
-
M. L. Smythe and M. von Itzstein, J. Am. Chein. Soc., 116, 2725 (1994). Design and Synthesis of a Biologically Active Antibody Mimic Based on an Antibody-Antigen Crystal Structure.
-
(1994)
J. Am. Chein. Soc.
, vol.116
, pp. 2725
-
-
Smythe, M.L.1
Von Itzstein, M.2
-
205
-
-
0027324832
-
Protein β-Turn Mimetics II: Design, Synthesis, and Evaluation in the Cyclic Peptide Gramicidin S
-
W. C. Ripka, G. V. De Lucca, A. C. Bach II, R. S. Pottorf, and J. M. Blaney, Tetrahedron, 49, 3609 (1993). Protein β-Turn Mimetics II: Design, Synthesis, and Evaluation in the Cyclic Peptide Gramicidin S.
-
(1993)
Tetrahedron
, vol.49
, pp. 3609
-
-
Ripka, W.C.1
De Lucca, G.V.2
Bach II, A.C.3
Pottorf, R.S.4
Blaney, J.M.5
-
206
-
-
0023059915
-
Insect Hypertrehalosemic Hormone: Isolation and Primary Structure from Blaberus discoidalis Cockroaches
-
T. K. Hayes, L. L. Keeley, and D. K. Knight, Biochem. Biophys. Res. Commun., 140, 674 (1986). Insect Hypertrehalosemic Hormone: Isolation and Primary Structure from Blaberus discoidalis Cockroaches.
-
(1986)
Biochem. Biophys. Res. Commun.
, vol.140
, pp. 674
-
-
Hayes, T.K.1
Keeley, L.L.2
Knight, D.K.3
-
207
-
-
0027312409
-
Design and Synthesis of Hypertrehalosemic Hormone Mimetics
-
M. Sato, M. Kahn, Z. Lin, M. E. Johnson, and T. K. Hayes, Bioorg. Med. Chem. Lett., 3, 1277 (1993). Design and Synthesis of Hypertrehalosemic Hormone Mimetics.
-
(1993)
Bioorg. Med. Chem. Lett.
, vol.3
, pp. 1277
-
-
Sato, M.1
Kahn, M.2
Lin, Z.3
Johnson, M.E.4
Hayes, T.K.5
-
208
-
-
0017183201
-
The Crystal Structure of a Post-Synaptic Neurotoxin from Sea Snake at 2.2 a Resolution
-
G. A. Petsko and D. Tsernoglou, FEBS Lett., 68, 1 (1976). The Crystal Structure of a Post-Synaptic Neurotoxin from Sea Snake at 2.2 A Resolution.
-
(1976)
FEBS Lett.
, vol.68
, pp. 1
-
-
Petsko, G.A.1
Tsernoglou, D.2
-
210
-
-
0343674306
-
The Design and Synthesis of a Nonpeptide Mimic of Erabutoxin
-
M. Kahn, B. Chen, and P. Zieske, Heterocycles, 25, 29 (1987). The Design and Synthesis of a Nonpeptide Mimic of Erabutoxin.
-
(1987)
Heterocycles
, vol.25
, pp. 29
-
-
Kahn, M.1
Chen, B.2
Zieske, P.3
-
211
-
-
0025949076
-
Design and Synthesis of Nonpeptide Mimetics of Jaspamide
-
M. Kahn, H. Nakanishi, T. Su, J. Y.-H. Lee, and M. E. Johnson, Int. J. Peptide Protein Res., 38, 324 (1991). Design and Synthesis of Nonpeptide Mimetics of Jaspamide.
-
(1991)
Int. J. Peptide Protein Res.
, vol.38
, pp. 324
-
-
Kahn, M.1
Nakanishi, H.2
Su, T.3
Lee, J.Y.-H.4
Johnson, M.E.5
-
212
-
-
0022534636
-
Jaspamide, a Modified Peptide from a Jaspis Sponge, with Insecticidal and Antifungal Activity
-
T. M. Zabriskie, J. A. Klocke, C. M. Ireland, A. H. Marcus, T. F. Molinski, D. J. Faulkner, C. Xu, and J. C. Clardy, J. Am. Chem. Soc., 108, 3123 (1986). Jaspamide, a Modified Peptide from a Jaspis Sponge, with Insecticidal and Antifungal Activity.
-
(1986)
J. Am. Chem. Soc.
, vol.108
, pp. 3123
-
-
Zabriskie, T.M.1
Klocke, J.A.2
Ireland, C.M.3
Marcus, A.H.4
Molinski, T.F.5
Faulkner, D.J.6
Xu, C.7
Clardy, J.C.8
-
213
-
-
0001586425
-
Probing a Molecular Model of Taste Utilizing Peptidomimetic Stereoisomers of 2-Aminocyclopentanecarboxylic Acid Methyl Ester
-
T. Yamazaki, Y.-F. Zhu, A. Probstl, R. K. Chadha, and M. Goodman, J. Org. Chem., 56, 6644 (1991). Probing a Molecular Model of Taste Utilizing Peptidomimetic Stereoisomers of 2-Aminocyclopentanecarboxylic Acid Methyl Ester.
-
(1991)
J. Org. Chem.
, vol.56
, pp. 6644
-
-
Yamazaki, T.1
Zhu, Y.-F.2
Probstl, A.3
Chadha, R.K.4
Goodman, M.5
-
214
-
-
33748247569
-
Conformational Requirements for Sweet-Tasting Peptides and Peptidomimetics
-
T. Yamazaki, E. Benedetti, D. Kent, and M. Goodman, Angew. Chem. Int. Ed. Engl., 33, 1437 (1994). Conformational Requirements for Sweet-Tasting Peptides and Peptidomimetics.
-
(1994)
Angew. Chem. Int. Ed. Engl.
, vol.33
, pp. 1437
-
-
Yamazaki, T.1
Benedetti, E.2
Kent, D.3
Goodman, M.4
-
215
-
-
0023986231
-
The Design and Synthesis of Mimetics of Peptide β-Turns
-
M. Kahn, S. Wilke, B. Chen, K. Fujita, Y-H. Lee, and M. E. Johnson, J. Mol. Recog., 1, 75 (1988). The Design and Synthesis of Mimetics of Peptide β-Turns.
-
(1988)
J. Mol. Recog.
, vol.1
, pp. 75
-
-
Kahn, M.1
Wilke, S.2
Chen, B.3
Fujita, K.4
Lee, Y.-H.5
Johnson, M.E.6
-
216
-
-
0000603109
-
Design, Synthesis and Conformational Analysis of a Novel Spiro-Bicyclic System as a Type II β-Turn Peptidomimetic
-
M. J. Genin and R. L. Johnson, J. Am. Chem. Soc., 114, 8778 (1992). Design, Synthesis and Conformational Analysis of a Novel Spiro-Bicyclic System as a Type II β-Turn Peptidomimetic.
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 8778
-
-
Genin, M.J.1
Johnson, R.L.2
-
217
-
-
0025305030
-
Design and Synthesis of a Protein β-Turn Mimetic
-
G. L. Olson, M. E. Voss, D. E. Hill, M. Kahn, V. S. Madison, and C. M. Cook, J. Am. Chem. Soc., 112, 323 (1990). Design and Synthesis of a Protein β-Turn Mimetic.
-
(1990)
J. Am. Chem. Soc.
, vol.112
, pp. 323
-
-
Olson, G.L.1
Voss, M.E.2
Hill, D.E.3
Kahn, M.4
Madison, V.S.5
Cook, C.M.6
-
218
-
-
0030503687
-
Free Energy by Molecular Simulation
-
K. B. Lipkowitz and D. B. Boyd, Eds., VCH Publishers, New York
-
T. P. Straatsma, in Reviews in Computational Chemistry, K. B. Lipkowitz and D. B. Boyd, Eds., VCH Publishers, New York, 1996, Vol. 9, pp. 81-127. Free Energy by Molecular Simulation.
-
(1996)
Reviews in Computational Chemistry
, vol.9
, pp. 81-127
-
-
Straatsma, T.P.1
-
219
-
-
0000956129
-
A Perspective of Modern Methods in Computer-Aided Drug Design
-
K. B. Lipkowitz and D. B. Boyd, Eds., VCH Publishers, New York
-
See also, L. M. Balbes, S. W. Mascarella, and D. B. Boyd, in Reviews in Computational Chemistry, K. B. Lipkowitz and D. B. Boyd, Eds., VCH Publishers, New York, Vol. 5, pp. 357-379. A Perspective of Modern Methods in Computer-Aided Drug Design.
-
Reviews in Computational Chemistry
, vol.5
, pp. 357-379
-
-
Balbes, L.M.1
Mascarella, S.W.2
Boyd, D.B.3
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