-
3
-
-
79955766939
-
Aromatic rings in chemical and biological recognition: Energetics and structures
-
Salonen LM, Ellermann M, Diederich F. Aromatic rings in chemical and biological recognition: Energetics and structures. Angew Chem Int Ed 2011;50:4808-42
-
(2011)
Angew. Chem. Int. Ed.
, vol.50
, pp. 4808-4842
-
-
Salonen, L.M.1
Ellermann, M.2
Diederich, F.3
-
5
-
-
77953631827
-
A medicinal chemist's guide to molecular interactions
-
Bissantz C, Kuhn B, Stahl M. A medicinal chemist's guide to molecular interactions. J Med Chem 2010;53:5061-84
-
(2010)
J. Med. Chem.
, vol.53
, pp. 5061-5084
-
-
Bissantz, C.1
Kuhn, B.2
Stahl, M.3
-
7
-
-
34147213661
-
Lone pair-Aromatic interactions: To stabilize or not to stabilize
-
Egli M, Sarkhel S. Lone pair-Aromatic interactions: To stabilize or not to stabilize. Acc Chem Res 2007;40:197-205
-
(2007)
Acc. Chem. Res.
, vol.40
, pp. 197-205
-
-
Egli, M.1
Sarkhel, S.2
-
8
-
-
33947666527
-
Propensities of polar and aromatic amino acids in noncanonical interactions: Nonbonded contacts analysis of protein-ligand complexes in crystal structures
-
DOI 10.1021/jm061038a
-
Imai YN, Inoue Y, Yamamoto Y. Propensities of polar and aromatic amino acid in noncanonical interactions: Nonbonded contacts analysis of protein-ligand complexes in crystal structures. J Med Chem 2007;50:1189-96 (Pubitemid 46496319)
-
(2007)
Journal of Medicinal Chemistry
, vol.50
, Issue.6
, pp. 1189-1196
-
-
Imai, Y.N.1
Inoue, Y.2
Yamamoto, Y.3
-
10
-
-
20444479110
-
Halogen bonding based recognition processes: A world parallel to hydrogen bonding
-
DOI 10.1021/ar0400995
-
Metrangolo P, Neukirch H, Pilati T, et al. Halogen bonding based recognition process: A world parallel to hydrogen bonding. Acc Chem Res 2005;38:386-95 (Pubitemid 40816650)
-
(2005)
Accounts of Chemical Research
, vol.38
, Issue.5
, pp. 386-395
-
-
Metrangolo, P.1
Neukirch, H.2
Pilati, T.3
Resnati, G.4
-
11
-
-
33846271376
-
Engineering functional materials by halogen bonding
-
DOI 10.1002/pola.21725
-
Metrangolo P, Resnati G, Pilati T, et al. Engineering functional materials by halogen bonding. J Polym Sci A Polym Chem 2007;45:1-15 (Pubitemid 46119494)
-
(2007)
Journal of Polymer Science, Part A: Polymer Chemistry
, vol.45
, Issue.1
, pp. 1-15
-
-
Metrangolo, P.1
Resnati, G.2
Pilati, T.3
Liantonio, R.4
Meyer, F.5
-
13
-
-
77955809684
-
Halogen bonding: A general route in anion recognition and coordination
-
Cavallo G, Metrangolo P, Pilati T, et al. Halogen bonding: A general route in anion recognition and coordination. Chem Soc Rev 2010;39:3772-84
-
(2010)
Chem. Soc. Rev.
, vol.39
, pp. 3772-3784
-
-
Cavallo, G.1
Metrangolo, P.2
Pilati, T.3
-
14
-
-
49649098999
-
Halogen versus hydrogen
-
Metrangolo P, Resnati G. Halogen versus hydrogen. Science 2008;321:918-19
-
(2008)
Science
, vol.321
, pp. 918-919
-
-
Metrangolo, P.1
Resnati, G.2
-
15
-
-
72149112462
-
Halogen bonding in metal-organic-supramolecular networks
-
Bertani R, Sgarbossa P, Venzo A, et al. Halogen bonding in metal-organic-supramolecular networks. Coord Chem Rev 2010;254:677-95
-
(2010)
Coord Chem. Rev.
, vol.254
, pp. 677-695
-
-
Bertani, R.1
Sgarbossa, P.2
Venzo, A.3
-
16
-
-
62449180950
-
Nonporous organic solids capable of dynamically resolving mixtures of diiodoperfluoroalkanes
-
Metrangolo P, Carcenac Y, Lahtinen M, et al. Nonporous organic solids capable of dynamically resolving mixtures of diiodoperfluoroalkanes. Science 2009;323:1461-4
-
(2009)
Science
, vol.323
, pp. 1461-1464
-
-
Metrangolo, P.1
Carcenac, Y.2
Lahtinen, M.3
-
17
-
-
77954598483
-
The halogen bond: An interim perspective
-
Legon AC. The halogen bond: An interim perspective. Phys Chem Chem Phys 2010;12:7736-47
-
(2010)
Phys. Chem. Chem. Phys.
, vol.12
, pp. 7736-7747
-
-
Legon, A.C.1
-
19
-
-
50249112252
-
Halogen bonded supramolecular complexes and networks
-
Rissanen K. Halogen bonded supramolecular complexes and networks. CrystEngComm 2008;10:1107-13
-
(2008)
Cryst. Eng. Comm.
, vol.10
, pp. 1107-1113
-
-
Rissanen, K.1
-
22
-
-
82955171705
-
Assaying the energies of biological halogen bonds
-
Carter M, Ho PS. Assaying the energies of biological halogen bonds. Cryst Growth Des 2011;11:5087-95
-
(2011)
Cryst. Growth Des.
, vol.11
, pp. 5087-5095
-
-
Carter, M.1
Ho, P.S.2
-
23
-
-
77950789591
-
Halogen atoms in the modern medicinal chemistry: Hints for the drug design
-
Hernandes MZ, Cavalcanti SMT, Moreira DRM, et al. Halogen atoms in the modern medicinal chemistry: Hints for the drug design. Curr Drug Targets 2010;11:303-14
-
(2010)
Curr. Drug Targets
, vol.11
, pp. 303-314
-
-
Hernandes, M.Z.1
Cavalcanti, S.M.T.2
Moreira, D.R.M.3
-
24
-
-
65649131517
-
Evaluating the potential for halogen bonding in the oxyanion hole of ketosteroid isomerase using unnatural amino acid mutagenesis
-
Kraut DA, Churchill MJ, Dawson PE, et al. Evaluating the potential for halogen bonding in the oxyanion hole of ketosteroid isomerase using unnatural amino acid mutagenesis. ACS Chem Biol 2009;4:269-73
-
(2009)
ACS Chem. Biol.
, vol.4
, pp. 269-273
-
-
Kraut, D.A.1
Churchill, M.J.2
Dawson, P.E.3
-
25
-
-
67849128457
-
Halogen bonds as orthogonal molecular interactions to hydrogen bonds
-
Voth AR, Khuu P, Oishi K, et al. Halogen bonds as orthogonal molecular interactions to hydrogen bonds. Nat Chem 2009;1:74-9
-
(2009)
Nat. Chem.
, vol.1
, pp. 74-9
-
-
Voth, A.R.1
Khuu, P.2
Oishi, K.3
-
26
-
-
33846687108
-
An overview of halogen bonding
-
DOI 10.1007/s00894-006-0154-7, Special Issue
-
Politzer P, Lane P, Concha MC, et al. An overview of halogen bonding. J Mol Model 2007;13:305-11 (Pubitemid 46189160)
-
(2007)
Journal of Molecular Modeling
, vol.13
, Issue.2
, pp. 305-311
-
-
Politzer, P.1
Lane, P.2
Concha, M.C.3
Ma, Y.4
Murray, J.S.5
-
29
-
-
77954593406
-
Halogen bonding: An electrostatically-driven highly directional noncovalent interaction
-
Politzer P, Murray JS, Clark T. Halogen bonding: An electrostatically- driven highly directional noncovalent interaction. Phys Chem Chem Phys 2010;12:7748-57
-
(2010)
Phys. Chem. Chem. Phys.
, vol.12
, pp. 7748-7757
-
-
Politzer, P.1
Murray, J.S.2
Clark, T.3
-
30
-
-
78650168509
-
Directional weak intermolecular interactions: Tau-hole bonding
-
Murray JS, Riley KE, Politer P, et al. Directional weak intermolecular interactions: Tau-hole bonding. Aust J Chem 2010;63:1598-607
-
(2010)
Aust. J. Chem.
, vol.63
, pp. 1598-1607
-
-
Murray, J.S.1
Riley, K.E.2
Politer, P.3
-
31
-
-
77649091129
-
A tridentate halogen-bonding receptor for tight binding of halide anions
-
Sarwar MG, Dragisic B, Sagoo S, et al. A tridentate halogen-bonding receptor for tight binding of halide anions. Angew Chem Int Ed 2010;49:1674-7
-
(2010)
Angew. Chem. Int. Ed.
, vol.49
, pp. 1674-1677
-
-
Sarwar, M.G.1
Dragisic, B.2
Sagoo, S.3
-
32
-
-
79960031261
-
Anion receptors composed of hydrogen- and halogen-bond donor groups: Modulating selectivity with combinations of district noncovalent interactions
-
Chudzinski MG, McClary CA, Taylor MS. Anion receptors composed of hydrogen- and halogen-bond donor groups: Modulating selectivity with combinations of district noncovalent interactions. J Am Chem Soc 2010;133:10559-68
-
(2010)
J. Am. Chem. Soc.
, vol.133
, pp. 10559-68
-
-
Chudzinski, M.G.1
McClary, C.A.2
Taylor, M.S.3
-
33
-
-
82455205707
-
Ditopic ion transport systems: Anion-pi interactions and halogen bonds at work
-
Jentzsch AV, Emery D, Mareda J, et al. Ditopic ion transport systems: Anion-pi interactions and halogen bonds at work. Angew Chem Int Ed 2011;50:11675-8
-
(2011)
Angew. Chem. Int. Ed.
, vol.50
, pp. 11675-8
-
-
Jentzsch, A.V.1
Emery, D.2
Mareda, J.3
-
34
-
-
34347385022
-
Halogen bonding and the design of new materials: Organic bromides, chlorides and perhaps even fluorides as donors
-
DOI 10.1007/s00894-007-0176-9, International conference and workshop: Modeling and Design of Molecular Materials, 10-15 September 2006, Wrocklaw, Poland
-
Politzer P, Murray JS, Concha MC. Halogen bonding and the design of new materials: Organic bromines, chlorides and perhaps even fluorides as donors. J Mol Model 2007;13:643-50 (Pubitemid 47023388)
-
(2007)
Journal of Molecular Modeling
, vol.13
, Issue.6-7
, pp. 643-650
-
-
Politzer, P.1
Murray, J.S.2
Concha, M.C.3
-
35
-
-
36048948031
-
Ab initio investigation of halogen bonding interactions involving fluorine as an electron acceptor
-
Lu YX, Zou JW, Yu QS, et al. Ab initio investigation of halogen bonding interactions involving fluorine as an electron acceptor. Chem Phys Lett 2007;449:6-10
-
(2007)
Chem. Phys. Lett.
, vol.449
, pp. 6-10
-
-
Lu, Y.X.1
Zou, J.W.2
Yu, Q.S.3
-
36
-
-
80054984935
-
The fluorine atom as a halogen bond donor, viz a positive site
-
Metrangolo P, Murray JS, Pilati T, et al. The fluorine atom as a halogen bond donor, viz. a positive site. CrystEngComm 2011;13:6593-6
-
(2011)
Cryst. Eng. Comm.
, vol.13
, pp. 6593-6596
-
-
Metrangolo, P.1
Murray, J.S.2
Pilati, T.3
-
37
-
-
80052540036
-
Fluorine-centered halogen bonding: A factor in recognition phenomena and reactivity
-
Metrangolo P, Murray JS, Pilati T, et al. Fluorine-centered halogen bonding: A factor in recognition phenomena and reactivity. Cryst Growth Des 2011;11:4238-46
-
(2011)
Cryst. Growth Des.
, vol.11
, pp. 4238-4246
-
-
Metrangolo, P.1
Murray, J.S.2
Pilati, T.3
-
38
-
-
70349155924
-
C-X H contacts in biomolecular systems: How they contribute to protein-ligand binding affinity
-
Lu Y, Wang Y, Xu Z, et al. C-X.H contacts in biomolecular systems: How they contribute to protein-ligand binding affinity. J Phys Chem B 2009;113:12615-21
-
(2009)
J. Phys. Chem. B.
, vol.113
, pp. 12615-21
-
-
Lu, Y.1
Wang, Y.2
Xu, Z.3
-
39
-
-
17044421336
-
Orthogonal multipolar interactions in structural chemistry and biology
-
Paulini R, Muller K, Dieherich F. Orthogonal multipolar interactions in structural chemistry and biology. Angew Chem Int Ed 2005;44:1788-805
-
(2005)
Angew Chem. Int. Ed.
, vol.44
, pp. 1788-1805
-
-
Paulini, R.1
Muller, K.2
Dieherich, F.3
-
40
-
-
0000243556
-
Understanding the Behavior of Halogens as Hydrogen Bond Acceptors
-
DOI 10.1021/cg015522k
-
Brammer L, Bruton EA, Sherwood P. Understanding the behavior of halogens as hydrogen bond acceptors. Cryst Growth Des 2001;1:277-90 (Pubitemid 33680419)
-
(2001)
Crystal Growth and Design
, vol.1
, Issue.4
, pp. 277-290
-
-
Brammer, L.1
Bruton, E.A.2
Sherwood, P.3
-
41
-
-
10044239249
-
Halogen bonds in biological molecules
-
DOI 10.1073/pnas.0407607101
-
Auffinger P, Hays FA, Westhof E, et al. Halogen bonds in biological molecules. Proc Natl Acad Sci USA 2004;101:16789-94 (Pubitemid 39601317)
-
(2004)
Proceedings of the National Academy of Sciences of the United States of America
, vol.101
, Issue.48
, pp. 16789-16794
-
-
Auffinger, P.1
Hays, F.A.2
Westhof, E.3
Ho, P.S.4
-
42
-
-
34548821001
-
The role of halogen bonding in inhibitor recognition and binding by protein kinases
-
DOI 10.2174/156802607781696846
-
Voth AR, Ho PS. The role of halogen bonding in inhibitor recognition and binding by protein kinases. Curr Top Med Chem 2007;7:1336-48 (Pubitemid 47484763)
-
(2007)
Current Topics in Medicinal Chemistry
, vol.7
, Issue.14
, pp. 1336-1348
-
-
Voth, A.R.1
Ho, P.S.2
-
43
-
-
77951793408
-
Nonbonding interactions of organic halogens in biological systems: Implications for drug discovery and biomolecular design
-
Lu Y, Wang Y, Zhu W. Nonbonding interactions of organic halogens in biological systems: Implications for drug discovery and biomolecular design. Phys Chem Chem Phys 2010;12:4543-51
-
(2010)
Phys. Chem. Chem. Phys.
, vol.12
, pp. 4543-4551
-
-
Lu, Y.1
Wang, Y.2
Zhu, W.3
-
44
-
-
79954586104
-
Halogen bonding in halocarbon-protein complexes: A structural survey
-
Parisini E, Metrangolo P, Pilati T. Halogen bonding in halocarbon-protein complexes: A structural survey. Chem Soc Rev 2011;40:2267-78
-
(2011)
Chem. Soc. Rev.
, vol.40
, pp. 2267-2278
-
-
Parisini, E.1
Metrangolo, P.2
Pilati, T.3
-
45
-
-
65649095907
-
Halogen bonding - A novel interaction for rational drug design
-
Lu Y, Shi T, Wang Y, et al. Halogen bonding - A novel interaction for rational drug design. J Med Chem 2009;52:2854-62
-
(2009)
J. Med. Chem.
, vol.52
, pp. 2854-2862
-
-
Lu, Y.1
Shi, T.2
Wang, Y.3
-
46
-
-
79955526259
-
How does halogen bonding behave in solution? A theoretical study using implicit solvation model
-
Lu Y, Li H, Zhu X, et al. How does halogen bonding behave in solution? A theoretical study using implicit solvation model. J Phys Chem A 2011;115:4467-75
-
(2011)
J. Phys. Chem. A.
, vol.115
, pp. 4467-4475
-
-
Lu, Y.1
Li, H.2
Zhu, X.3
-
47
-
-
84859580690
-
Effects of solvent on weak halogen bonds: Density functional theory calculations
-
Lu Y, Li H, Zhu X, et al. Effects of solvent on weak halogen bonds: Density functional theory calculations. Int J Quantum Chem 2012;112:1421-30
-
(2012)
Int. J. Quantum. Chem.
, Issue.112
, pp. 1421-1430
-
-
Lu, Y.1
Li, H.2
Zhu, X.3
-
48
-
-
79959921557
-
Semiempirical quantum mechanical method PM6-DH2X describes the geometry and energetics of CK2-inhibitor complexes involving halogen bonds well, while the empirical potential fails
-
Dobes P, Rezac J, Fanfrlik J, et al. Semiempirical quantum mechanical method PM6-DH2X describes the geometry and energetics of CK2-inhibitor complexes involving halogen bonds well, while the empirical potential fails. J Phys Chem B 2011;115:8581-9
-
(2011)
J. Phys. Chem. B.
, vol.115
, pp. 8581-8589
-
-
Dobes, P.1
Rezac, J.2
Fanfrlik, J.3
-
49
-
-
80053555768
-
Strength and character of halogen bonds in protein-ligand complexes
-
Riley KE, Hobza P. Strength and character of halogen bonds in protein-ligand complexes. Cryst Growth Des 2011;11:4272-8
-
(2011)
Cryst. Growth Des.
, vol.11
, pp. 4272-4278
-
-
Riley, K.E.1
Hobza, P.2
-
50
-
-
79959739959
-
Molecular mechanical study of halogen bonding in drug design
-
Ibrahim MAA. Molecular mechanical study of halogen bonding in drug design. J Comput Chem 2011;32:2564-74
-
(2011)
J. Comput. Chem.
, vol.32
, pp. 2564-2574
-
-
Ibrahim, M.A.A.1
-
51
-
-
80054898012
-
Performance assessment of semiempirical molecular orbital methods in describing halogen bonding: Quantum mechanical and quantum mechanical/molecular mechanical-molecular dynamics study
-
Ibrahim MAA. Performance assessment of semiempirical molecular orbital methods in describing halogen bonding: quantum mechanical and quantum mechanical/molecular mechanical-molecular dynamics study. J Chem Inf Model 2011;51:2549-59
-
(2011)
J. Chem. Inf. Model
, vol.51
, pp. 2549-2559
-
-
Ibrahim, M.A.A.1
-
52
-
-
80055038428
-
Halogen bonding in ligand-receptor systems in the framework of classical force fields
-
Rendine S, Pieraccini S, Forni A, et al. Halogen bonding in ligand-receptor systems in the framework of classical force fields. Phys Chem Chem Phys 2011;13:19508-16
-
(2011)
Phys. Chem. Chem. Phys.
, vol.13
, pp. 19508-16
-
-
Rendine, S.1
Pieraccini, S.2
Forni, A.3
-
53
-
-
0344927100
-
3-Iodo-4-phenoxypyridinones (IOPY's), a new family of highly potent non-nucleoside inhibitors of HIV-1 reverse transcriptase
-
DOI 10.1016/j.bmcl.2003.09.045
-
Benjahad A, Guillemont J, Andries K. 3-Iodo-4-phenoxypyridinones (IOPY's), a new family of highly potent non-nucleoside inhibitors of HIV-1 reverse transcriptase. Bioorg Med Chem Lett 2003;13:4309-12 (Pubitemid 37490809)
-
(2003)
Bioorganic and Medicinal Chemistry Letters
, vol.13
, Issue.24
, pp. 4309-4312
-
-
Benjahad, A.1
Guillemont, J.2
Andries, K.3
Nguyen, C.H.4
Grierson, D.S.5
-
54
-
-
28144445329
-
Crystal structures for HIV-1 reverse transcriptase in complexes with three pyridinone derivatives: A new class of non-nucleoside inhibitors effective against a broad range of drug-resistant strains
-
DOI 10.1021/jm0500323
-
Himmel DM, Das K, Clark AD, et al. Crystal structures for HIV-1 reverse transcriptase in complexes with three pyridinone derivatives: A new class of non-nucleoside inhibitors effective against a broad range of drug-resistant strains. J Med Chem 2005;48:7582-91 (Pubitemid 41698799)
-
(2005)
Journal of Medicinal Chemistry
, vol.48
, Issue.24
, pp. 7582-7591
-
-
Himmel, D.M.1
Das, K.2
Clark Jr., A.D.3
Hughes, S.H.4
Benjahad, A.5
Oumouch, S.6
Guillemont, J.7
Coupa, S.8
Poncelet, A.9
Csoka, I.10
Meyer, C.11
Andries, K.12
Nguyen, C.H.13
Grierson, D.S.14
Arnold, E.15
-
55
-
-
0037032835
-
The protein kinase complement of the human genome
-
DOI 10.1126/science.1075762
-
Manning G, Whyte DB, Martinez R, et al. The protein kinase complement of the human genome. Science 2002;298:1912-34 (Pubitemid 35425239)
-
(2002)
Science
, vol.298
, Issue.5600
, pp. 1912-1934
-
-
Manning, G.1
Whyte, D.B.2
Martinez, R.3
Hunter, T.4
Sudarsanam, S.5
-
56
-
-
0036527429
-
Protein kinases-The major drug targets of the twenty-first century
-
Cohen P. Protein kinases-The major drug targets of the twenty-first century? Nat Rev Drug Discov 2001;1:309-15
-
(2001)
Nat. Rev. Drug Discov.
, vol.1
, pp. 309-315
-
-
Cohen, P.1
-
57
-
-
33748942862
-
The isoform-specific functions of the c-Jun N-terminal kinases (JNKs): Differences revealed by gene targeting
-
DOI 10.1002/bies.20458
-
Bogoyevitch MA. The isoform-specific functions of the c-Jun N-Terminal Kinases (JNKs): Differences revealed by gene targeting. Bioessays 2006;28:923-34 (Pubitemid 44433755)
-
(2006)
BioEssays
, vol.28
, Issue.9
, pp. 923-934
-
-
Bogoyevitch, M.A.1
-
58
-
-
0036710767
-
Pharmacological inhibitors of cyclin-dependent kinases
-
DOI 10.1016/S0165-6147(02)02071-0, PII S0165614702020710
-
Knockaert M, Greengard P, Meijer L. Pharmacological inhibitors of cyclin-dependent kinases. Trends Pharmacol Sci 2002;23:417-25 (Pubitemid 35247771)
-
(2002)
Trends in Pharmacological Sciences
, vol.23
, Issue.9
, pp. 417-425
-
-
Knockaert, M.1
Greengard, P.2
Meijer, L.3
-
59
-
-
27744504303
-
Inspecting the structure-activity relationship of protein kinase CK2 inhibitors derived from tetrabromo-benzimidazole
-
DOI 10.1016/j.chembiol.2005.08.015, PII S1074552105002711
-
Battistutta R, Mazzorana M, Sarno S, et al. Inspecting the structure-Activity relationship of protein kinase CK2 inhibitors derived from tetrabromo-benzimidazole. Chem Biol 2005;12:1211-19 (Pubitemid 41628256)
-
(2005)
Chemistry and Biology
, vol.12
, Issue.11
, pp. 1211-1219
-
-
Battistutta, R.1
Mazzorana, M.2
Sarno, S.3
Kazimierczuk, Z.4
Zanotti, G.5
Pinna, L.A.6
-
60
-
-
70349321218
-
Structural bases of protein kinase CK2 inhibitor
-
Battistutta R. Structural bases of protein kinase CK2 inhibitor. Cell Mol Life Sci 2009;66:1868-89
-
(2009)
Cell Mol. Life Sci.
, vol.66
, pp. 1868-1889
-
-
Battistutta, R.1
-
61
-
-
77956968392
-
Halogen bonds from the basis for selective P-TEFb inhibitor by DRB
-
Baumli S, Endicott JA, Johnson LN. Halogen bonds from the basis for selective P-TEFb inhibitor by DRB. Chem Biol 2010;17:931-6
-
(2010)
Chem. Biol.
, vol.17
, pp. 931-936
-
-
Baumli, S.1
Endicott, J.A.2
Johnson, L.N.3
-
62
-
-
79251579303
-
Specific CLK inhibitors from a novel chemotype for regulation of alternative splicing
-
Fedorov O, Huber K, Eisenreich A, et al. Specific CLK inhibitors from a novel chemotype for regulation of alternative splicing. Chem Biol 2011;18:67-76
-
(2011)
Chem. Biol.
, vol.18
, pp. 67-76
-
-
Fedorov, O.1
Huber, K.2
Eisenreich, A.3
-
63
-
-
79251562528
-
Kinase inhibitor that hinges on halogen bonds
-
Grant SK, Lunney EA. Kinase inhibitor that hinges on halogen bonds. Chem Biol 2011;18:3-4
-
(2011)
Chem. Biol.
, vol.18
, pp. 3-4
-
-
Grant, S.K.1
Lunney, E.A.2
-
64
-
-
0027210135
-
Resistance to thyroid hormone
-
Refetoff S. Resistance to thyroid hormone. Clin Lab Med 1993;13:563-81 (Pubitemid 23267627)
-
(1993)
Clinics in Laboratory Medicine
, vol.13
, Issue.3
, pp. 563-581
-
-
Refetoff, S.1
-
65
-
-
72949118944
-
Role of halogen bonds in thyroid hormone receptor selectivity: Pharmacophore-based 3D-QSSR studies
-
Valadares NF, Salum LB, Polikarpov I, et al. Role of halogen bonds in thyroid hormone receptor selectivity: Pharmacophore-based 3D-QSSR studies. J Chem Inf Model 2009;49:2606-16
-
(2009)
J. Chem. Inf. Model.
, vol.49
, pp. 2606-2616
-
-
Valadares, N.F.1
Salum, L.B.2
Polikarpov, I.3
-
66
-
-
0026567907
-
Response of a protein structure to cavity-creating mutations and its relation to the hydrophobic effect
-
Eriksson AE, Baase WA, Zhang XJ, et al. Response of a protein structure to cavity-creating mutations and its relation to the hydrophobic effect. Science 1992;255:178-83
-
(1992)
Science
, vol.255
, pp. 178-183
-
-
Eriksson, A.E.1
Baase, W.A.2
Zhang, X.J.3
-
67
-
-
0026509036
-
A cavity-containing mutant of T4 lysozyme is stabilized by buried benzene
-
Eriksson AE, Baase WA, Wozniak JA, et al. A cavity-containing mutant of T4 lysozyme is stabilized by buried benzene. Nature 1992;355:371-3
-
(1992)
Nature
, vol.355
, pp. 371-373
-
-
Eriksson, A.E.1
Baase, W.A.2
Wozniak, J.A.3
-
68
-
-
58149091254
-
Halogenated benzenes bound within a non-polar cavity in T4 lysozyme provide examples of i S and i Se halogen-bonding
-
Liu L, Basse WA, Matthews BW. Halogenated benzenes bound within a non-polar cavity in T4 lysozyme provide examples of I S and I Se halogen-bonding. J Mol Biol 2009;385:595-605
-
(2009)
J. Mol. Biol.
, vol.385
, pp. 595-605
-
-
Liu, L.1
Basse, W.A.2
Matthews, B.W.3
-
69
-
-
22244460783
-
Probing the subpockets of factor Xa reveals two binding modes for inhibitors based on a 2-carboxyindole scaffold: A study combining structure-activity relationship and X-ray crystallography
-
DOI 10.1021/jm0490540
-
Nazare M, Will DW, Matter H, et al. Probing the subpockets of factor Xa reveals two binding modes for inhibitors based on a 2-carboxyindole scaffold: A study combining structure-Activity relationship and X-ray crystallography. J Med Chem 2005;48:4511-25 (Pubitemid 40993413)
-
(2005)
Journal of Medicinal Chemistry
, vol.48
, Issue.14
, pp. 4511-4525
-
-
Nazare, M.1
Will, D.W.2
Matter, H.3
Schreuder, H.4
Ritter, K.5
Urmann, M.6
Essrich, M.7
Bauer, A.8
Wagner, M.9
Czech, J.10
Lorenz, M.11
Laux, V.12
Wehner, V.13
-
70
-
-
18344364519
-
Structural requirements for factor Xa inhibition by 3-oxybenzamides with neutral P1 substituents: Combining X-ray crystallography, 3D-QSAR, and tailored scoring functions
-
DOI 10.1021/jm049187l
-
Matter H, Will DW, Nazare M, et al. Structural requirements for factor Xa inhibitor by 3-Oxybenzamides with neutral P1 substituents: Combining X-ray Crystallography, 3D-QSAR, and tailored scoring functions. J Med Chem 2005;48:3290-312 (Pubitemid 40637203)
-
(2005)
Journal of Medicinal Chemistry
, vol.48
, Issue.9
, pp. 3290-3312
-
-
Matter, H.1
Will, D.W.2
Nazare, M.3
Schreuder, H.4
Laux, V.5
Wehner, V.6
-
71
-
-
57349194524
-
Design, structural-Activity relationship, X-ray crystal structure, and energetic contributions of a critical P1 phamacophore: 3-chloroindole-7-ylbased factor Xa inhibitors
-
Shi Y, Sitkoff D, Zhang J, et al. Design, structural-Activity relationship, X-ray crystal structure, and energetic contributions of a critical P1 phamacophore: 3-chloroindole-7-ylbased factor Xa inhibitors. J Med Chem 2008;51:7541-51
-
(2008)
J. Med. Chem.
, vol.51
, pp. 7541-7551
-
-
Shi, Y.1
Sitkoff, D.2
Zhang, J.3
-
72
-
-
70349786321
-
Evidence for C-Cl/C-Br pi interactions as an important contribution to protein-ligand binding affinity
-
Matter H, Nazare M, Gussregen S, et al. Evidence for C-Cl/C-Br pi interactions as an important contribution to protein-ligand binding affinity. Angew Chem Int Ed 2009;48:2911-16
-
(2009)
Angew Chem. Int. Ed
, vol.48
, pp. 2911-2916
-
-
Matter, H.1
Nazare, M.2
Gussregen, S.3
-
73
-
-
78650706711
-
Systematic investigation of halogen bonding in protein-ligand interactions
-
Hardegger LA, Kuhn B, Spinnler B, et al. Systematic investigation of halogen bonding in protein-ligand interactions. Angew Chem Int Ed 2011;50:314-18
-
(2011)
Angew Chem. Int. Ed.
, vol.50
, pp. 314-318
-
-
Hardegger, L.A.1
Kuhn, B.2
Spinnler, B.3
-
74
-
-
80055006729
-
Halogen bonding at the active sites of human cathepsin L and MEK1 kinase: Efficient interactions in different environments
-
Hardegger LA, Kuhn B, Spinnler B, et al. Halogen bonding at the active sites of human cathepsin L and MEK1 kinase: Efficient interactions in different environments. ChemMedChem 2011;6:2048-54
-
(2011)
Chem. Med. Chem.
, vol.6
, pp. 2048-2054
-
-
Hardegger, L.A.1
Kuhn, B.2
Spinnler, B.3
-
75
-
-
79961216539
-
Utilization of halogen bond in lead optimization: A case study of rational design of potent phosphodiesterase type 5 (PDE 5) inhibitors
-
Xu Z, Liu Z, Chen T, et al. Utilization of halogen bond in lead optimization: A case study of rational design of potent phosphodiesterase type 5 (PDE 5) inhibitors. J Med Chem 2011;54:5607-11
-
(2011)
J. Med. Chem.
, vol.54
, pp. 5607-5611
-
-
Xu, Z.1
Liu, Z.2
Chen, T.3
-
76
-
-
65649131517
-
Evaluating the potential for halogen bonding in the oxyanion hole of ketosteroid isomerase using unnatural amino acid mutagenesis
-
Kraut DA, Churchill MJ, Dawson PE, et al. Evaluating the potential for halogen bonding in the oxyanion hole of ketosteroid isomerase using unnatural amino acid mutagenesis. ACS Chem Biol 2009;4:269-73
-
(2009)
ACS Chem. Biol.
, vol.4
, pp. 269-273
-
-
Kraut, D.A.1
Churchill, M.J.2
Dawson, P.E.3
|