-
1
-
-
84962428730
-
Proton transfer in hydrogen-bonded pyridine/acid systems: The role of higher aggregation
-
Balevicius V, Bariseviciute R, Aidas K, Svoboda I, Ehrenberg H, and Fuess H (2007) Proton transfer in hydrogen-bonded pyridine/acid systems: The role of higher aggregation. Phys Chem Chem Phys 9:3181-3189.
-
(2007)
Phys Chem Chem Phys
, vol.9
, pp. 3181-3189
-
-
Balevicius, V.1
Bariseviciute, R.2
Aidas, K.3
Svoboda, I.4
Ehrenberg, H.5
Fuess, H.6
-
2
-
-
77957055780
-
Integrated methods for the construction of three-dimensional models and computational probing of structure-function relations in G protein-coupled receptors
-
(Sealfon SC, ed) Academic Press, Waltham, MA
-
Ballesteros JA and Weinstein H (1995) Integrated methods for the construction of three-dimensional models and computational probing of structure-function relations in G protein-coupled receptors, in Receptor Molecular Biology, Vol. 25 (Sealfon SC, ed) pp 366-428, Academic Press, Waltham, MA.
-
(1995)
Receptor Molecular Biology
, vol.25
, pp. 366-428
-
-
Ballesteros, J.A.1
Weinstein, H.2
-
3
-
-
84864408766
-
Synthesis and application of the first radioligand targeting the allosteric binding pocket of chemokine receptor CXCR3
-
Bernat V, Heinrich MR, Baumeister P, Buschauer A, and Tschammer N (2012) Synthesis and application of the first radioligand targeting the allosteric binding pocket of chemokine receptor CXCR3. ChemMedChem 7:1481-1489.
-
(2012)
Chem Med Chem
, vol.7
, pp. 1481-1489
-
-
Bernat, V.1
Heinrich, M.R.2
Baumeister, P.3
Buschauer, A.4
Tschammer, N.5
-
4
-
-
0038526362
-
Identification of the first nonpeptidergic inverse agonist for a constitutively active viral-encoded G proteincoupled receptor
-
Casarosa P, Menge WM, Minisini R, Otto C, van Heteren J, Jongejan A, Timmerman H, Moepps B, Kirchhoff F, and Mertens T et al. (2003) Identification of the first nonpeptidergic inverse agonist for a constitutively active viral-encoded G proteincoupled receptor. J Biol Chem 278:5172-5178.
-
(2003)
J Biol Chem
, vol.278
, pp. 5172-5178
-
-
Casarosa, P.1
Menge, W.M.2
Minisini, R.3
Otto, C.4
Van Heteren, J.5
Jongejan, A.6
Timmerman, H.7
Moepps, B.8
Kirchhoff, F.9
Mertens, T.10
-
5
-
-
41149156578
-
Molecular modeling of the second extracellular loop of G-protein coupled receptors and its implication on structure-based virtual screening
-
de Graaf C, Foata N, Engkvist O, and Rognan D (2008) Molecular modeling of the second extracellular loop of G-protein coupled receptors and its implication on structure-based virtual screening. Proteins 71:599-620.
-
(2008)
Proteins
, vol.71
, pp. 599-620
-
-
De Graaf, C.1
Foata, N.2
Engkvist, O.3
Rognan, D.4
-
6
-
-
81555222803
-
Identification of a novel allosteric binding site in the CXCR2 chemokine receptor
-
de Kruijf P, Lim HD, Roumen L, Renjaän VA, Zhao J, Webb ML, Auld DS, Wijkmans JCHM, Zaman GJR, and Smit MJ et al. (2011) Identification of a novel allosteric binding site in the CXCR2 chemokine receptor. Mol Pharmacol 80:1108-1118.
-
(2011)
Mol Pharmacol
, vol.80
, pp. 1108-1118
-
-
De Kruijf, P.1
Lim, H.D.2
Roumen, L.3
Renjaän, V.A.4
Zhao, J.5
Webb, M.L.6
Auld, D.S.7
Wijkmans, J.C.H.M.8
Zaman, G.J.R.9
Smit, M.J.10
-
7
-
-
14244254079
-
Site-directed mutagenesis of CC chemokine receptor 1 reveals the mechanism of action of UCB 35625, a small molecule chemokine receptor antagonist
-
de Mendonça FL, da Fonseca PC, Phillips RM, Saldanha JW, Williams TJ, and Pease JE (2005) Site-directed mutagenesis of CC chemokine receptor 1 reveals the mechanism of action of UCB 35625, a small molecule chemokine receptor antagonist. J Biol Chem 280:4808-4816.
-
(2005)
J Biol Chem
, vol.280
, pp. 4808-4816
-
-
De Mendonça, F.L.1
Da Fonseca, P.C.2
Phillips, R.M.3
Saldanha, J.W.4
Williams, T.J.5
Pease, J.E.6
-
8
-
-
33745224117
-
Metal ion site engineering indicates a global toggle switch model for seventransmembrane receptor activation
-
Elling CE, Frimurer TM, Gerlach LO, Jorgensen R, Holst B, and Schwartz TW (2006) Metal ion site engineering indicates a global toggle switch model for seventransmembrane receptor activation. J Biol Chem 281:17337-17346.
-
(2006)
J Biol Chem
, vol.281
, pp. 17337-17346
-
-
Elling, C.E.1
Frimurer, T.M.2
Gerlach, L.O.3
Jorgensen, R.4
Holst, B.5
Schwartz, T.W.6
-
9
-
-
0035918313
-
The TXP motif in the second transmembrane helix of CCR5. A structural determinant of chemokine-induced activation
-
Govaerts C, Blanpain C, Deupi X, Ballet S, Ballesteros JA, Wodak SJ, Vassart G, Pardo L, and Parmentier M (2001) The TXP motif in the second transmembrane helix of CCR5. A structural determinant of chemokine-induced activation. J Biol Chem 276:13217-13225.
-
(2001)
J Biol Chem
, vol.276
, pp. 13217-13225
-
-
Govaerts, C.1
Blanpain, C.2
Deupi, X.3
Ballet, S.4
Ballesteros, J.A.5
Wodak, S.J.6
Vassart, G.7
Pardo, L.8
Parmentier, M.9
-
10
-
-
21144439416
-
Pharmacological characterization of CXC chemokine receptor 3 ligands and a small molecule antagonist
-
Heise CE, Pahuja A, Hudson SC, Mistry MS, Putnam AL, Gross MM, Gottlieb PA, Wade WS, Kiankarimi M, and Schwarz D et al. (2005) Pharmacological characterization of CXC chemokine receptor 3 ligands and a small molecule antagonist. J Pharmacol Exp Ther 313:1263-1271.
-
(2005)
J Pharmacol Exp Ther
, vol.313
, pp. 1263-1271
-
-
Heise, C.E.1
Pahuja, A.2
Hudson, S.C.3
Mistry, M.S.4
Putnam, A.L.5
Gross, M.M.6
Gottlieb, P.A.7
Wade, W.S.8
Kiankarimi, M.9
Schwarz, D.10
-
11
-
-
84855492353
-
A selective and potent CXCR3 antagonist SCH 546738 attenuates the development of autoimmune diseases and delays graft rejection
-
Jenh CH, Cox MA, Cui L, Reich EP, Sullivan L, Chen SC, Kinsley D, Qian S, Kim SH, and Rosenblum S et al. (2012) A selective and potent CXCR3 antagonist SCH 546738 attenuates the development of autoimmune diseases and delays graft rejection. BMC Immunol 13:2.
-
(2012)
BMC Immunol
, vol.13
, pp. 2
-
-
Jenh, C.H.1
Cox, M.A.2
Cui, L.3
Reich, E.P.4
Sullivan, L.5
Chen, S.C.6
Kinsley, D.7
Qian, S.8
Kim, S.H.9
Rosenblum, S.10
-
12
-
-
34547177384
-
Molecular interaction of a potent nonpeptide agonist with the chemokine receptor CCR8
-
Jensen PC, Nygaard R, Thiele S, Elder A, Zhu G, Kolbeck R, Ghosh S, Schwartz TW, and Rosenkilde MM (2007) Molecular interaction of a potent nonpeptide agonist with the chemokine receptor CCR8. Mol Pharmacol 72:327-340.
-
(2007)
Mol Pharmacol
, vol.72
, pp. 327-340
-
-
Jensen, P.C.1
Nygaard, R.2
Thiele, S.3
Elder, A.4
Zhu, G.5
Kolbeck, R.6
Ghosh, S.7
Schwartz, T.W.8
Rosenkilde, M.M.9
-
13
-
-
34249321265
-
Discovery and optimization of a series of quinazolinone-derived antagonists of CXCR3
-
Johnson M, Li AR, Liu J, Fu Z, Zhu L, Miao S, Wang X, Xu Q, Huang A, and Marcus A et al. (2007) Discovery and optimization of a series of quinazolinone-derived antagonists of CXCR3. Bioorg Med Chem Lett 17:3339-3343.
-
(2007)
Bioorg Med Chem Lett
, vol.17
, pp. 3339-3343
-
-
Johnson, M.1
Li, A.R.2
Liu, J.3
Fu, Z.4
Zhu, L.5
Miao, S.6
Wang, X.7
Xu, Q.8
Huang, A.9
Marcus, A.10
-
14
-
-
80255129399
-
III. Identification of novel CXCR3 chemokine receptor antagonists with a pyrazinyl-piperazinyl-piperidine scaffold
-
Kim SH, Anilkumar GN, Zawacki LG, Zeng Q, Yang DY, Shao Y, Dong G, Xu X, Yu W, and Jiang Y et al. (2011) III. Identification of novel CXCR3 chemokine receptor antagonists with a pyrazinyl-piperazinyl-piperidine scaffold. Bioorg Med Chem Lett 21:6982-6986.
-
(2011)
Bioorg Med Chem Lett
, vol.21
, pp. 6982-6986
-
-
Kim, S.H.1
Anilkumar, G.N.2
Zawacki, L.G.3
Zeng, Q.4
Yang, D.Y.5
Shao, Y.6
Dong, G.7
Xu, X.8
Yu, W.9
Jiang, Y.10
-
15
-
-
83555164893
-
Targeting chemokine receptors in chronic inflammatory diseases: An extensive review
-
Koelink PJ, Overbeek SA, Braber S, de Kruijf P, Folkerts G, Smit MJ, and Kraneveld AD (2012) Targeting chemokine receptors in chronic inflammatory diseases: An extensive review. Pharmacol Ther 133:1-18.
-
(2012)
Pharmacol Ther
, vol.133
, pp. 1-18
-
-
Koelink, P.J.1
Overbeek, S.A.2
Braber, S.3
De Kruijf, P.4
Folkerts, G.5
Smit, M.J.6
Kraneveld, A.D.7
-
16
-
-
40849098660
-
Molecular interactions of CCR5 with major classes of small-molecule anti-HIV CCR5 antagonists
-
Kondru R, Zhang J, Ji C, Mirzadegan T, Rotstein D, Sankuratri S, and Dioszegi M (2008) Molecular interactions of CCR5 with major classes of small-molecule anti-HIV CCR5 antagonists. Mol Pharmacol 73:789-800.
-
(2008)
Mol Pharmacol
, vol.73
, pp. 789-800
-
-
Kondru, R.1
Zhang, J.2
Ji, C.3
Mirzadegan, T.4
Rotstein, D.5
Sankuratri, S.6
Dioszegi, M.7
-
17
-
-
84873344962
-
From heptahelical bundle to hits from the Haystack: Structure-based virtual screening for GPCR ligands
-
Kooistra AJ, Roumen L, Leurs R, de Esch IJ, and de Graaf C (2013) From heptahelical bundle to hits from the Haystack: Structure-based virtual screening for GPCR ligands. Methods Enzymol 522:279-336.
-
(2013)
Methods Enzymol
, vol.522
, pp. 279-336
-
-
Kooistra, A.J.1
Roumen, L.2
Leurs, R.3
De Esch, I.J.4
De Graaf, C.5
-
18
-
-
69949133380
-
CXCR3, inflammation, and autoimmune diseases
-
Lacotte S, Brun S, Muller S, and Dumortier H (2009) CXCR3, inflammation, and autoimmune diseases. Ann N Y Acad Sci 1173:310-317.
-
(2009)
Ann N y Acad Sci
, vol.1173
, pp. 310-317
-
-
Lacotte, S.1
Brun, S.2
Muller, S.3
Dumortier, H.4
-
19
-
-
68349155551
-
Optimization of a series of quinazolinone-derived antagonists of CXCR3
-
Liu J, Fu Z, Li AR, Johnson M, Zhu L, Marcus A, Danao J, Sullivan T, Tonn G, and Collins T et al. (2009) Optimization of a series of quinazolinone- derived antagonists of CXCR3. Bioorg Med Chem Lett 19:5114-5118.
-
(2009)
Bioorg Med Chem Lett
, vol.19
, pp. 5114-5118
-
-
Liu, J.1
Fu, Z.2
Li, A.R.3
Johnson, M.4
Zhu, L.5
Marcus, A.6
Danao, J.7
Sullivan, T.8
Tonn, G.9
Collins, T.10
-
20
-
-
68349137669
-
Novel CXCR3 antagonists with a piperazinyl-piperidine core
-
McGuinness BF, Carroll CD, Zawacki LG, Dong G, Yang C, Hobbs DW, Jacob-Samuel B, Hall JW, 3rd, Jenh CH, and Kozlowski JA et al. (2009) Novel CXCR3 antagonists with a piperazinyl-piperidine core. Bioorg Med Chem Lett 19: 5205-5208.
-
(2009)
Bioorg Med Chem Lett
, vol.19
, pp. 5205-5208
-
-
McGuinness, B.F.1
Carroll, C.D.2
Zawacki, L.G.3
Dong, G.4
Yang, C.5
Hobbs, D.W.6
Jacob-Samuel, B.7
Hall, J.W.8
Jenh III, C.H.9
Kozlowski, J.A.10
-
21
-
-
84890618398
-
-
Patent WO2006088919. 2006 Aug
-
McGuinness BF, Rosenblum SF, Kozlowksi JA, Anilkumar GN, Kim SH, Shih N-Y, Jenh C-H, Zavodny PJ, Hobbs DW, Dong G, et al. (2006) inventors, Schering Corporation, assignee. Pyridyl and phenyl substituted piperazine-piperidines with CXCR3 antagonist activity. Patent WO2006088919. 2006 Aug 24.
-
(2006)
Inventors, Schering Corporation, Assignee Pyridyl and Phenyl Substituted Piperazine-piperidines with CXCR3 Antagonist Activity
, vol.24
-
-
McGuinness, B.F.1
Rosenblum, S.F.2
Kozlowksi, J.A.3
Anilkumar, G.N.4
Kim, S.H.5
Shih, N.-Y.6
Jenh, C.-H.7
Zavodny, P.J.8
Hobbs, D.W.9
Dong, G.10
-
22
-
-
84860866415
-
Small molecule chemokine mimetics suggest a molecular basis for the observation that CXCL10 and CXCL11 are allosteric ligands of CXCR3
-
Nedjai B, Li H, Stroke IL, Wise EL, Webb ML, Merritt JR, Henderson I, Klon AE, Cole AG, and Horuk R et al. (2012) Small molecule chemokine mimetics suggest a molecular basis for the observation that CXCL10 and CXCL11 are allosteric ligands of CXCR3. Br J Pharmacol 166:912-923.
-
(2012)
Br J Pharmacol
, vol.166
, pp. 912-923
-
-
Nedjai, B.1
Li, H.2
Stroke, I.L.3
Wise, E.L.4
Webb, M.L.5
Merritt, J.R.6
Henderson, I.7
Klon, A.E.8
Cole, A.G.9
Horuk, R.10
-
23
-
-
54349117013
-
Identification of a putative intracellular allosteric antagonist binding-site in the CXC chemokine receptors 1 and 2
-
Nicholls DJ, Tomkinson NP, Wiley KE, Brammall A, Bowers L, Grahames C, Gaw A, Meghani P, Shelton P, and Wright TJ et al. (2008) Identification of a putative intracellular allosteric antagonist binding-site in the CXC chemokine receptors 1 and 2. Mol Pharmacol 74:1193-1202.
-
(2008)
Mol Pharmacol
, vol.74
, pp. 1193-1202
-
-
Nicholls, D.J.1
Tomkinson, N.P.2
Wiley, K.E.3
Brammall, A.4
Bowers, L.5
Grahames, C.6
Gaw, A.7
Meghani, P.8
Shelton, P.9
Wright, T.J.10
-
24
-
-
38949205852
-
Chemokines and cancer: Migration, intracellular signalling and intercellular communication in the microenvironment
-
O'Hayre M, Salanga CL, Handel TM, and Allen SJ (2008) Chemokines and cancer: Migration, intracellular signalling and intercellular communication in the microenvironment. Biochem J 409:635-649.
-
(2008)
Biochem J
, vol.409
, pp. 635-649
-
-
O'Hayre, M.1
Salanga, C.L.2
Handel, T.M.3
Allen, S.J.4
-
25
-
-
33847147674
-
Activation of the CXCR3 chemokine receptor through anchoring of a small molecule chelator ligand between TM-III,-IV, and-VI
-
Rosenkilde MM, Andersen MB, Nygaard R, Frimurer TM, and Schwartz TW (2007) Activation of the CXCR3 chemokine receptor through anchoring of a small molecule chelator ligand between TM-III,-IV, and-VI. Mol Pharmacol 71:930-941.
-
(2007)
Mol Pharmacol
, vol.71
, pp. 930-941
-
-
Rosenkilde, M.M.1
Andersen, M.B.2
Nygaard, R.3
Frimurer, T.M.4
Schwartz, T.W.5
-
26
-
-
84873087758
-
C (X)CR in silico: Computer-aided prediction of chemokine receptor-ligand interactions
-
Roumen L, Scholten DJ, de Kruijf P, de Esch IJP, Leurs R, and de Graaf C (2012) C (X)CR in silico: Computer-aided prediction of chemokine receptor-ligand interactions. Drug Discov Today Technol 9:e227-e314.
-
(2012)
Drug Discov Today Technol
, vol.9
-
-
Roumen, L.1
Scholten, D.J.2
De Kruijf, P.3
De Esch, I.J.P.4
Leurs, R.5
De Graaf, C.6
-
27
-
-
77949861512
-
A common intracellular allosteric binding site for antagonists of the CXCR2 receptor
-
Salchow K, Bond ME, Evans SC, Press NJ, Charlton SJ, Hunt PA, and Bradley ME (2010) A common intracellular allosteric binding site for antagonists of the CXCR2 receptor. Br J Pharmacol 159:1429-1439.
-
(2010)
Br J Pharmacol
, vol.159
, pp. 1429-1439
-
-
Salchow, K.1
Bond, M.E.2
Evans, S.C.3
Press, N.J.4
Charlton, S.J.5
Hunt, P.A.6
Bradley, M.E.7
-
28
-
-
81555213635
-
Pharmacological modulation of chemokine receptor function
-
Scholten DJ, Canals M, Maussang D, Roumen L, Smit MJ, Wijtmans M, de Graaf C, Vischer HF, and Leurs R (2012a) Pharmacological modulation of chemokine receptor function. Br J Pharmacol 165:1617-1643.
-
(2012)
Br J Pharmacol
, vol.165
, pp. 1617-1643
-
-
Scholten, D.J.1
Canals, M.2
Maussang, D.3
Roumen, L.4
Smit, M.J.5
Wijtmans, M.6
De Graaf, C.7
Vischer, H.F.8
Leurs, R.9
-
29
-
-
84860855040
-
Pharmacological characterization of a small-molecule agonist for the chemokine receptor CXCR3
-
Scholten DJ, Canals M, Wijtmans M, de Munnik SM, Nguyen P, Verzijl D, de Esch IJP, Vischer HF, Smit MJ, and Leurs R (2012b) Pharmacological characterization of a small-molecule agonist for the chemokine receptor CXCR3. Br J Pharmacol 166:898-911.
-
(2012)
Br J Pharmacol
, vol.166
, pp. 898-911
-
-
Scholten, D.J.1
Canals, M.2
Wijtmans, M.3
De Munnik, S.M.4
Nguyen, P.5
Verzijl, D.6
De Esch, I.J.P.7
Vischer, H.F.8
Smit, M.J.9
Leurs, R.10
-
30
-
-
33144459843
-
Molecular mechanism of 7TM receptor activation - A global toggle switch model
-
Schwartz TW, Frimurer TM, Holst B, Rosenkilde MM, and Elling CE (2006) Molecular mechanism of 7TM receptor activation - a global toggle switch model. Annu Rev Pharmacol Toxicol 46:481-519.
-
(2006)
Annu Rev Pharmacol Toxicol
, vol.46
, pp. 481-519
-
-
Schwartz, T.W.1
Frimurer, T.M.2
Holst, B.3
Rosenkilde, M.M.4
Elling, C.E.5
-
31
-
-
79951726314
-
II. SAR studies of pyridyl-piperazinylpiperidine derivatives as CXCR3 chemokine antagonists
-
Shao Y, Anilkumar GN, Carroll CD, Dong G, Hall JW, 3rd, Hobbs DW, Jiang Y, Jenh CH, Kim SH, and Kozlowski JA et al. (2011) II. SAR studies of pyridyl-piperazinylpiperidine derivatives as CXCR3 chemokine antagonists. Bioorg Med Chem Lett 21:1527-1531.
-
(2011)
Bioorg Med Chem Lett
, vol.21
, pp. 1527-1531
-
-
Shao, Y.1
Anilkumar, G.N.2
Carroll, C.D.3
Dong, G.4
Hall, J.W.5
Hobbs Iii., D.W.6
Jiang, Y.7
Jenh, C.H.8
Kim, S.H.9
Kozlowski, J.A.10
-
32
-
-
79960070651
-
Structure of the human histamine H1 receptor complex with doxepin
-
Shimamura T, Shiroishi M, Weyand S, Tsujimoto H, Winter G, Katritch V, Abagyan R, Cherezov V, Liu W, and Han GW et al. (2011) Structure of the human histamine H1 receptor complex with doxepin. Nature 475:65-70.
-
(2011)
Nature
, vol.475
, pp. 65-70
-
-
Shimamura, T.1
Shiroishi, M.2
Weyand, S.3
Tsujimoto, H.4
Winter, G.5
Katritch, V.6
Abagyan, R.7
Cherezov, V.8
Liu, W.9
Han, G.W.10
-
33
-
-
19544362723
-
Synthesis and structure-activity relationship of 3-phenyl-3H-quinazolin- 4-one derivatives as CXCR3 chemokine receptor antagonists
-
Storelli S, Verdijk P, Verzijl D, Timmerman H, van de Stolpe AC, Tensen CP, Smit MJ, De Esch IJP, and Leurs R (2005) Synthesis and structure-activity relationship of 3-phenyl-3H-quinazolin-4-one derivatives as CXCR3 chemokine receptor antagonists. Bioorg Med Chem Lett 15:2910-2913.
-
(2005)
Bioorg Med Chem Lett
, vol.15
, pp. 2910-2913
-
-
Storelli, S.1
Verdijk, P.2
Verzijl, D.3
Timmerman, H.4
Van De Stolpe, A.C.5
Tensen, C.P.6
Smit, M.J.7
De Esch Ijp8
Leurs, R.9
-
34
-
-
34250857933
-
Synthesis and structure-activity relationships of 3Hquinazolin-4-ones and 3H-pyrido [2,3-d]pyrimidin-4-ones as CXCR3 receptor antagonists
-
Storelli S, Verzijl D, Al-Badie J, Elders N, Bosch L, Timmerman H, Smit MJ, De Esch IJP, and Leurs R (2007) Synthesis and structure-activity relationships of 3Hquinazolin-4-ones and 3H-pyrido[2,3-d]pyrimidin-4-ones as CXCR3 receptor antagonists. Arch Pharm (Weinheim) 340:281-291.
-
(2007)
Arch Pharm (Weinheim)
, vol.340
, pp. 281-291
-
-
Storelli, S.1
Verzijl, D.2
Al-Badie, J.3
Elders, N.4
Bosch, L.5
Timmerman, H.6
Smit, M.J.7
De Esch, I.J.P.8
Leurs, R.9
-
35
-
-
30144441512
-
A chemogenomic analysis of the transmembrane binding cavity of human G-protein-coupled receptors
-
Surgand J-S, Rodrigo J, Kellenberger E, and Rognan D (2006) A chemogenomic analysis of the transmembrane binding cavity of human G-protein-coupled receptors. Proteins 62:509-538.
-
(2006)
Proteins
, vol.62
, pp. 509-538
-
-
Surgand, J.-S.1
Rodrigo, J.2
Kellenberger, E.3
Rognan, D.4
-
36
-
-
84884673669
-
Structure of the CCR5 chemokine receptor-HIV entry inhibitor maraviroc complex
-
Tan Q, Zhu Y, Li J, Chen Z, Han GW, Kufareva I, Li T, Ma L, Fenalti G, Li J, Zhang W, Xie X, Yang H, Jiang H, Cherezov V, Liu H, Stevens RC, Zhao Q, and Wu B (2013) Structure of the CCR5 chemokine receptor-HIV entry inhibitor maraviroc complex. Science 341:1387-1390.
-
(2013)
Science
, vol.341
, pp. 1387-1390
-
-
Tan, Q.1
Zhu, Y.2
Li, J.3
Chen, Z.4
Han, G.W.5
Kufareva, I.6
Li, T.7
Ma, L.8
Fenalti, G.9
Li, J.10
Zhang, W.11
Xie, X.12
Yang, H.13
Jiang, H.14
Cherezov, V.15
Liu, H.16
Stevens, R.C.17
Zhao, Q.18
Wu, B.19
-
37
-
-
61449202932
-
An inhibitory metabolite leads to doseand time-dependent pharmacokinetics of (R)-N-1-[3-(4-ethoxy-phenyl)-4-oxo-3,4-dihydro-pyrido[2,3-d]pyrimidin-2-yl]- ethyl-N-pyridin-3-yl-methyl-2-(4-trifluoromethoxyphenyl)-acetamide (AMG 487) in human subjects after multiple dosing
-
Tonn GR, Wong SG, Wong SC, Johnson MG, Ma J, Cho R, Floren LC, Kersey K, Berry K, and Marcus AP et al. (2009) An inhibitory metabolite leads to doseand time-dependent pharmacokinetics of (R)-N-1-[3-(4-ethoxy-phenyl)-4-oxo-3,4- dihydro-pyrido[2,3-d]pyrimidin-2-yl]-ethyl-N-pyridin-3-yl-methyl-2-(4- trifluoromethoxyphenyl)-acetamide (AMG 487) in human subjects after multiple dosing. Drug Metab Dispos 37:502-513.
-
(2009)
Drug Metab Dispos
, vol.37
, pp. 502-513
-
-
Tonn, G.R.1
Wong, S.G.2
Wong, S.C.3
Johnson, M.G.4
Ma, J.5
Cho, R.6
Floren, L.C.7
Kersey, K.8
Berry, K.9
Marcus, A.P.10
-
38
-
-
70450224667
-
Modelling of the membrane receptor CXCR3 and its complexes with CXCL9 CXCL10 and CXCL11 chemokines: Putative target for new drug design
-
Trotta T, Costantini S, and Colonna G (2009) Modelling of the membrane receptor CXCR3 and its complexes with CXCL9, CXCL10 and CXCL11 chemokines: Putative target for new drug design. Mol Immunol 47:332-339.
-
(2009)
Mol Immunol
, vol.47
, pp. 332-339
-
-
Trotta, T.1
Costantini, S.2
Colonna, G.3
-
39
-
-
33748747498
-
Predictions of CCR1 chemokine receptor structure and BX 471 antagonist binding followed by experimental validation
-
Vaidehi N, Schlyer S, Trabanino RJ, Floriano WB, Abrol R, Sharma S, Kochanny M, Koovakat S, Dunning L, and Liang M et al. (2006) Predictions of CCR1 chemokine receptor structure and BX 471 antagonist binding followed by experimental validation. J Biol Chem 281:27613-27620.
-
(2006)
J Biol Chem
, vol.281
, pp. 27613-27620
-
-
Vaidehi, N.1
Schlyer, S.2
Trabanino, R.J.3
Floriano, W.B.4
Abrol, R.5
Sharma, S.6
Kochanny, M.7
Koovakat, S.8
Dunning, L.9
Liang, M.10
-
40
-
-
38549146090
-
CXCR3 antagonist NBI-74330 attenuates atherosclerotic plaque formation in LDL receptor-deficient mice
-
van Wanrooij EJ, de Jager SC, van Es T, de Vos P, Birch HL, Owen DA, Watson RJ, Biessen EA, Chapman GA, and van Berkel TJ et al. (2008) CXCR3 antagonist NBI-74330 attenuates atherosclerotic plaque formation in LDL receptor-deficient mice. Arterioscler Thromb Vasc Biol 28:251-257.
-
(2008)
Arterioscler Thromb Vasc Biol
, vol.28
, pp. 251-257
-
-
Van Wanrooij, E.J.1
De Jager, S.C.2
Van Es, T.3
De Vos, P.4
Birch, H.L.5
Owen, D.A.6
Watson, R.J.7
Biessen, E.A.8
Chapman, G.A.9
Van Berkel, T.J.10
-
41
-
-
0041919542
-
Improved protein-ligand docking using GOLD
-
Verdonk ML, Cole JC, Hartshorn MJ, Murray CW, and Taylor RD (2003) Improved protein-ligand docking using GOLD. Proteins 52:609-623.
-
(2003)
Proteins
, vol.52
, pp. 609-623
-
-
Verdonk, M.L.1
Cole, J.C.2
Hartshorn, M.J.3
Murray, C.W.4
Taylor, R.D.5
-
42
-
-
42449086457
-
Noncompetitive antagonism and inverse agonism as mechanism of action of nonpeptidergic antagonists at primate and rodent CXCR3 chemokine receptors
-
Verzijl D, Storelli S, Scholten DJ, Bosch L, Reinhart TA, Streblow DN, Tensen CP, Fitzsimons CP, Zaman GJ, and Pease JE et al. (2008) Noncompetitive antagonism and inverse agonism as mechanism of action of nonpeptidergic antagonists at primate and rodent CXCR3 chemokine receptors. J Pharmacol Exp Ther 325: 544-555.
-
(2008)
J Pharmacol Exp Ther
, vol.325
, pp. 544-555
-
-
Verzijl, D.1
Storelli, S.2
Scholten, D.J.3
Bosch, L.4
Reinhart, T.A.5
Streblow, D.N.6
Tensen, C.P.7
Fitzsimons, C.P.8
Zaman, G.J.9
Pease, J.E.10
-
43
-
-
41149111580
-
Chemokines and their receptors: Drug targets in immunity and inflammation
-
Viola A and Luster AD (2008) Chemokines and their receptors: Drug targets in immunity and inflammation. Annu Rev Pharmacol Toxicol 48:171-197.
-
(2008)
Annu Rev Pharmacol Toxicol
, vol.48
, pp. 171-197
-
-
Viola, A.1
Luster, A.D.2
-
44
-
-
33747888160
-
Antagonism of CXCR3 inhibits lung metastasis in a murine model of metastatic breast cancer
-
Walser TC, Rifat S, Ma X, Kundu N, Ward C, Goloubeva O, Johnson MG, Medina JC, Collins TL, and Fulton AM (2006) Antagonism of CXCR3 inhibits lung metastasis in a murine model of metastatic breast cancer. Cancer Res 66:7701-7707.
-
(2006)
Cancer Res
, vol.66
, pp. 7701-7707
-
-
Walser, T.C.1
Rifat, S.2
Ma, X.3
Kundu, N.4
Ward, C.5
Goloubeva, O.6
Johnson, M.G.7
Medina, J.C.8
Collins, T.L.9
Fulton, A.M.10
-
45
-
-
15744391870
-
The CCR5 receptorbased mechanism of action of 873140, a potent allosteric noncompetitive HIV entry inhibitor
-
Watson C, Jenkinson S, Kazmierski W, and Kenakin T (2005) The CCR5 receptorbased mechanism of action of 873140, a potent allosteric noncompetitive HIV entry inhibitor. Mol Pharmacol 67:1268-1282.
-
(2005)
Mol Pharmacol
, vol.67
, pp. 1268-1282
-
-
Watson, C.1
Jenkinson, S.2
Kazmierski, W.3
Kenakin, T.4
-
46
-
-
84966314392
-
Therapeutic targeting of the CXCR3 receptor
-
(Smit MJ, Lira SA, and Leurs R eds) Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim, Germany
-
Wijtmans M, de Esch IJP, and Leurs R (2010) Therapeutic targeting of the CXCR3 receptor, in Chemokine Receptors as Drug Targets (Smit MJ, Lira SA, and Leurs R eds) pp 301-322, Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim, Germany.
-
(2010)
Chemokine Receptors As Drug Targets
, pp. 301-322
-
-
Wijtmans, M.1
De Esch, I.J.P.2
Leurs, R.3
-
47
-
-
79957493207
-
CXCR3 antagonists: Quaternary ammonium salts equipped with biphenyl-and polycycloaliphatic-anchors
-
Wijtmans M, Verzijl D, Bergmans S, Lai M, Bosch L, Smit MJ, de Esch IJP, and Leurs R (2011) CXCR3 antagonists: Quaternary ammonium salts equipped with biphenyl-and polycycloaliphatic-anchors. Bioorg Med Chem 19: 3384-3393.
-
(2011)
Bioorg Med Chem
, vol.19
, pp. 3384-3393
-
-
Wijtmans, M.1
Verzijl, D.2
Bergmans, S.3
Lai, M.4
Bosch, L.5
Smit, M.J.6
De Esch, I.J.P.7
Leurs, R.8
-
48
-
-
48149111878
-
Towards smallmolecule CXCR3 ligands with clinical potential
-
Wijtmans M, Verzijl D, Leurs R, de Esch IJP, and Smit MJ (2008) Towards smallmolecule CXCR3 ligands with clinical potential. ChemMedChem 3:861-872.
-
(2008)
Chem Med Chem
, vol.3
, pp. 861-872
-
-
Wijtmans, M.1
Verzijl, D.2
Leurs, R.3
De Esch, I.J.P.4
Smit, M.J.5
-
49
-
-
57349105727
-
Comparison of the potential multiple binding modes of bicyclam, monocylam, and noncyclam small-molecule CXC chemokine receptor 4 inhibitors
-
Wong RSY, Bodart V, Metz M, Labrecque J, Bridger G, and Fricker SP (2008) Comparison of the potential multiple binding modes of bicyclam, monocylam, and noncyclam small-molecule CXC chemokine receptor 4 inhibitors. Mol Pharmacol 74:1485-1495.
-
(2008)
Mol Pharmacol
, vol.74
, pp. 1485-1495
-
-
Wong, R.S.Y.1
Bodart, V.2
Metz, M.3
Labrecque, J.4
Bridger, G.5
Fricker, S.P.6
-
50
-
-
85027927015
-
Structures of the CXCR4 chemokine GPCR with smallmolecule and cyclic peptide antagonists
-
Wu B, Chien EY, Mol CD, Fenalti G, Liu W, Katritch V, Abagyan R, Brooun A, Wells P, and Bi FC et al. (2010) Structures of the CXCR4 chemokine GPCR with smallmolecule and cyclic peptide antagonists. Science 330:1066-1071.
-
(2010)
Science
, vol.330
, pp. 1066-1071
-
-
Wu, B.1
Chien, E.Y.2
Mol, C.D.3
Fenalti, G.4
Liu, W.5
Katritch, V.6
Abagyan, R.7
Brooun, A.8
Wells, P.9
Bi, F.C.10
-
51
-
-
0242335085
-
Molecular characterization of the chemokine receptor CXCR3: Evidence for the involvement of distinct extracellular domains in a multi-step model of ligand binding and receptor activation
-
Xanthou G, Williams TJ, and Pease JE (2003) Molecular characterization of the chemokine receptor CXCR3: Evidence for the involvement of distinct extracellular domains in a multi-step model of ligand binding and receptor activation. Eur J Immunol 33:2927-2936.
-
(2003)
Eur J Immunol
, vol.33
, pp. 2927-2936
-
-
Xanthou, G.1
Williams, T.J.2
Pease, J.E.3
-
52
-
-
84887319040
-
Real-space identification of intermolecular bonding with atomic force microscopy
-
Zhang J, Chen P, Yuan B, Ji W, Cheng Z, and Qiu X (2013) Real-space identification of intermolecular bonding with atomic force microscopy. Science 342:611-614.
-
(2013)
Science
, vol.342
, pp. 611-614
-
-
Zhang, J.1
Chen, P.2
Yuan, B.3
Ji, W.4
Cheng, Z.5
Qiu, X.6
|