-
1
-
-
37049034204
-
-
See
-
See: http://www.vpharm.com.
-
-
-
-
2
-
-
0035415863
-
Chemogenomic approaches to drug discovery
-
Caron, P. R.; Mullican, M. D.; Mashal, R. D.; Wilson, K. P.; Su, M. S.; Murcko, M. A. Chemogenomic approaches to drug discovery. Curr. Opin Chem. Biol. 2001, 5, 464-470.
-
(2001)
Curr. Opin Chem. Biol
, vol.5
, pp. 464-470
-
-
Caron, P.R.1
Mullican, M.D.2
Mashal, R.D.3
Wilson, K.P.4
Su, M.S.5
Murcko, M.A.6
-
3
-
-
0034878886
-
A novel chemogenomics knowledge-based ligand design strategy - Application to G-protein-coupled receptors
-
Jacoby, E. A novel chemogenomics knowledge-based ligand design strategy - Application to G-protein-coupled receptors. Quant. Struct.-Act. Relat. 2001, 20, 115-123.
-
(2001)
Quant. Struct.-Act. Relat
, vol.20
, pp. 115-123
-
-
Jacoby, E.1
-
4
-
-
84954223299
-
-
Kubinyi, H, Müller, G, Eds, Wiley-VCH: Weinheim, Germany
-
Chemogenomics in Drug Discovery: A Medicinal Chemistry Perspective; Kubinyi, H., Müller, G., Eds.; Wiley-VCH: Weinheim, Germany, 2004.
-
(2004)
Chemogenomics in Drug Discovery: A Medicinal Chemistry Perspective
-
-
-
6
-
-
4544220560
-
Novel cyclooxygenase-1 inhibitors discovered using affinity fingerprints
-
Hsu, N.; Cai, D.; Damodaran, K.; Gomez, R. F.; Keck, J. G.; Laborde, E.; Lum, R. T.; Macke, T. J.; Martin, G.; Schow, S. R.; Simon, R. J.; Villar, H. O.; Wick, M. M.; Beroza, P. Novel cyclooxygenase-1 inhibitors discovered using affinity fingerprints. J. Med. Chem. 2004, 47, 4875-4880.
-
(2004)
J. Med. Chem
, vol.47
, pp. 4875-4880
-
-
Hsu, N.1
Cai, D.2
Damodaran, K.3
Gomez, R.F.4
Keck, J.G.5
Laborde, E.6
Lum, R.T.7
Macke, T.J.8
Martin, G.9
Schow, S.R.10
Simon, R.J.11
Villar, H.O.12
Wick, M.M.13
Beroza, P.14
-
7
-
-
20944443990
-
Identification and characterization of novel benzil (diphenylethane-1,2-dione) analogues as inhibitors of mammalian carboxylesterases
-
Wadkins, R. M.; Hyatt, J. L.; Wei, X.; Yoon, K. J. P.; Wierdl, M.; Edwards, C. C.; Morton, C. L.; Obenauer, J. C.; Damodaran, K.; Beroza, P.; Danks, M. K.; Potter, P. M. Identification and characterization of novel benzil (diphenylethane-1,2-dione) analogues as inhibitors of mammalian carboxylesterases. J. Med. Chem. 2005, 48, 2906-2915.
-
(2005)
J. Med. Chem
, vol.48
, pp. 2906-2915
-
-
Wadkins, R.M.1
Hyatt, J.L.2
Wei, X.3
Yoon, K.J.P.4
Wierdl, M.5
Edwards, C.C.6
Morton, C.L.7
Obenauer, J.C.8
Damodaran, K.9
Beroza, P.10
Danks, M.K.11
Potter, P.M.12
-
8
-
-
22944479010
-
A physicogenetic method to assign ligand-binding relationships between 7TM receptors
-
Frimurer, T. M.; Ulven, T.; Elling, C. E.; Gerlach, L.-O.; Kostenis, E.; Högberg, T. A physicogenetic method to assign ligand-binding relationships between 7TM receptors. Bioorg. Med. Chem. Lett. 2005, 15, 3707-3712.
-
(2005)
Bioorg. Med. Chem. Lett
, vol.15
, pp. 3707-3712
-
-
Frimurer, T.M.1
Ulven, T.2
Elling, C.E.3
Gerlach, L.-O.4
Kostenis, E.5
Högberg, T.6
-
9
-
-
4544224293
-
4-Acylamino-and 4-ureidobenzamides as melanin-concentrating hormone (MCH) receptor 1 antagonists
-
Receveur, J.-M.; Bjurling, E.; Ulven, T.; Little, P. B.; Norregaard, P. K.; Högberg, T. 4-Acylamino-and 4-ureidobenzamides as melanin-concentrating hormone (MCH) receptor 1 antagonists. Bioorg. Med. Chem. Lett. 2004, 14, 5075-5080.
-
(2004)
Bioorg. Med. Chem. Lett
, vol.14
, pp. 5075-5080
-
-
Receveur, J.-M.1
Bjurling, E.2
Ulven, T.3
Little, P.B.4
Norregaard, P.K.5
Högberg, T.6
-
10
-
-
37049020280
-
Discovery of the first nonpeptide, small-molecule, highly selective somatostatin receptor subtype 5 antagonists: A chemogenomics approach
-
Martin, R. E.; Green, L. G.; Guba, W.; Kratochwil, N.; Christ, A. Discovery of the first nonpeptide, small-molecule, highly selective somatostatin receptor subtype 5 antagonists: A chemogenomics approach. J. Med. Chem. 2007, 50, 6291-6294.
-
(2007)
J. Med. Chem
, vol.50
, pp. 6291-6294
-
-
Martin, R.E.1
Green, L.G.2
Guba, W.3
Kratochwil, N.4
Christ, A.5
-
11
-
-
0031035181
-
An information-intensive approach to the molecular pharmacology of cancer
-
Weinstein, J. N.; Myers, T. G.; O'Connor, P. M.; Friend, S. H.; Fornace, A. J., Jr.; Kohn, K. W.; Fojo, T.; Bates, S. E.; Rubinstein, L. V.; Anderson, N. L.; Buolamwini, J. K.; van Osdol, W. W.; Monks, A. P.; Scudiero, D. A.; Sausville, E. A.; Zaharevitz, D. W.; Bunow, B.; Viswanadhan, V. N.; Johnson, G. S.; Wittes, R. E.; Pauli, K. D. An information-intensive approach to the molecular pharmacology of cancer. Science 1997, 275, 343-349.
-
(1997)
Science
, vol.275
, pp. 343-349
-
-
Weinstein, J.N.1
Myers, T.G.2
O'Connor, P.M.3
Friend, S.H.4
Fornace Jr., A.J.5
Kohn, K.W.6
Fojo, T.7
Bates, S.E.8
Rubinstein, L.V.9
Anderson, N.L.10
Buolamwini, J.K.11
van Osdol, W.W.12
Monks, A.P.13
Scudiero, D.A.14
Sausville, E.A.15
Zaharevitz, D.W.16
Bunow, B.17
Viswanadhan, V.N.18
Johnson, G.S.19
Wittes, R.E.20
Pauli, K.D.21
more..
-
12
-
-
0029240364
-
Predicting ligand binding to proteins by affinity fingerprinting
-
Kauvar, L. M.; Higgins, D. L.; Villar, H. O.; Sportsman, J. R.; Engqvist-Goldstein, A.; Bukar, R.; Bauer, K. E.; Dilley, H.; Rocke, D. M. Predicting ligand binding to proteins by affinity fingerprinting. Chem. Biol. 1995, 2, 107-118.
-
(1995)
Chem. Biol
, vol.2
, pp. 107-118
-
-
Kauvar, L.M.1
Higgins, D.L.2
Villar, H.O.3
Sportsman, J.R.4
Engqvist-Goldstein, A.5
Bukar, R.6
Bauer, K.E.7
Dilley, H.8
Rocke, D.M.9
-
13
-
-
0032201120
-
Bioactive diversity and screening library selection via affinity fingerprinting
-
Dixon, S. L.; Villar, H. O. Bioactive diversity and screening library selection via affinity fingerprinting. J. Chem. Inf. Comput. Sci. 1998, 38, 1192-1203.
-
(1998)
J. Chem. Inf. Comput. Sci
, vol.38
, pp. 1192-1203
-
-
Dixon, S.L.1
Villar, H.O.2
-
14
-
-
0036668404
-
Chemoproteomics as a basis for post-genomic drug discovery
-
Beroza, P.; Villar, H. O.; Wick, M. M.; Martin, G. R. Chemoproteomics as a basis for post-genomic drug discovery. Drug Discovery Today 2002, 7, 807-814.
-
(2002)
Drug Discovery Today
, vol.7
, pp. 807-814
-
-
Beroza, P.1
Villar, H.O.2
Wick, M.M.3
Martin, G.R.4
-
15
-
-
0043031339
-
Predicting ADME properties and side effects: The BioPrint approach
-
Krejsa, C. M.; Horvath, D.; Rogalski, S. M.; Penzotti, J. E.; Mao, B.; Barbosa, F.; Migeon, J. C. Predicting ADME properties and side effects: The BioPrint approach. Curr. Opin. Drug Discovery Dev. 2003, 6, 470-480.
-
(2003)
Curr. Opin. Drug Discovery Dev
, vol.6
, pp. 470-480
-
-
Krejsa, C.M.1
Horvath, D.2
Rogalski, S.M.3
Penzotti, J.E.4
Mao, B.5
Barbosa, F.6
Migeon, J.C.7
-
16
-
-
12244275244
-
Biological spectra analysis: Linking biological activity profiles to molecular structure
-
Fliri, A. F.; Loging, W. T.; Thadeio, P. F.; Volkmann, R. A. Biological spectra analysis: Linking biological activity profiles to molecular structure. Proc. Natl. Acad. Sci. U.S.A. 2005, 102, 261-266.
-
(2005)
Proc. Natl. Acad. Sci. U.S.A
, vol.102
, pp. 261-266
-
-
Fliri, A.F.1
Loging, W.T.2
Thadeio, P.F.3
Volkmann, R.A.4
-
17
-
-
32344440237
-
Analysis of drug-induced effect patterns to link structure and side effects of medicines
-
Fliri, A. F.; Loging, W. T.; Thadeio, P. F.; Volkmann, R. A. Analysis of drug-induced effect patterns to link structure and side effects of medicines. Nat. Chem. Biol. 2005, 1, 389-397.
-
(2005)
Nat. Chem. Biol
, vol.1
, pp. 389-397
-
-
Fliri, A.F.1
Loging, W.T.2
Thadeio, P.F.3
Volkmann, R.A.4
-
18
-
-
27444447278
-
Biospectra analysis: Model proteome characterizations for linking molecular structure and biological response
-
Fliri, A. F.; Loging, W. T.; Thadeio, P. F.; Volkmann, R. A. Biospectra analysis: Model proteome characterizations for linking molecular structure and biological response. J. Med. Chem. 2005, 48, 6918-6925.
-
(2005)
J. Med. Chem
, vol.48
, pp. 6918-6925
-
-
Fliri, A.F.1
Loging, W.T.2
Thadeio, P.F.3
Volkmann, R.A.4
-
19
-
-
33746156959
-
Global mapping of pharmacological space
-
Paolini, G. V.; Shapland, R. H. B.; van Hoorn, W. P.; Mason, H. S.; Hopkins, A. L. Global mapping of pharmacological space. Nat. Biotechnol. 2006, 24, 805-815.
-
(2006)
Nat. Biotechnol
, vol.24
, pp. 805-815
-
-
Paolini, G.V.1
Shapland, R.H.B.2
van Hoorn, W.P.3
Mason, H.S.4
Hopkins, A.L.5
-
20
-
-
37049031180
-
-
See
-
See: http://www.cerep.fr/Cerep/Users/index.asp.
-
-
-
-
21
-
-
37049009659
-
-
is a registered trademark of Cerep SA. See the following website
-
BioPrint is a registered trademark of Cerep SA. See the following website: www.cerep.com.
-
BioPrint
-
-
-
22
-
-
0029783934
-
Neighborhood behavior: A useful concept for validation of "molecular diversity" descriptors
-
Patterson, D. E.; Cramer, R. D.; Ferguson, A. M.; Clark, R. D.; Weinberger, L. E. Neighborhood behavior: A useful concept for validation of "molecular diversity" descriptors. J. Med. Chem. 1996, 39, 3049-3059.
-
(1996)
J. Med. Chem
, vol.39
, pp. 3049-3059
-
-
Patterson, D.E.1
Cramer, R.D.2
Ferguson, A.M.3
Clark, R.D.4
Weinberger, L.E.5
-
23
-
-
37049039616
-
-
Daylight Chemical Information Systems, Inc
-
Daylight Toolkit 4.71, Daylight Chemical Information Systems, Inc., http://www.daylight.com.
-
Daylight Toolkit 4.71
-
-
-
24
-
-
0037068532
-
Do structurally similar molecules have similar biological activity
-
Martin, Y. C.; Kofron, J. L.; Traphagen, L. M. Do structurally similar molecules have similar biological activity. J. Med. Chem. 2002, 45, 4350-4358.
-
(2002)
J. Med. Chem
, vol.45
, pp. 4350-4358
-
-
Martin, Y.C.1
Kofron, J.L.2
Traphagen, L.M.3
-
25
-
-
0003641826
-
-
Maggiora G. M, Johnson, M. A, Eds, Wiley-Interscience: New York
-
Concepts and Applications of Molecular Similarity; Maggiora G. M., Johnson, M. A., Eds.; Wiley-Interscience: New York, 1990.
-
(1990)
Concepts and Applications of Molecular Similarity
-
-
|