-
1
-
-
33748751182
-
Chemogenomics: Structuring the drug discovery process to gene families
-
C.J. Harris, and A.P. Stevens Chemogenomics: structuring the drug discovery process to gene families Drug Discov. Today 11 2006 880 888
-
(2006)
Drug Discov. Today
, vol.11
, pp. 880-888
-
-
Harris, C.J.1
Stevens, A.P.2
-
2
-
-
79960578304
-
Drug design of GPCR ligands using physicogenetics and chemogenomics-principles and case studies
-
T.M. Frimurer, and T. Hogberg Drug design of GPCR ligands using physicogenetics and chemogenomics-principles and case studies Curr. Top. Med. Chem. 2011
-
(2011)
Curr. Top. Med. Chem.
-
-
Frimurer, T.M.1
Hogberg, T.2
-
3
-
-
79957997272
-
Thematic analysis: A chemogenomic approach to GPCR drug discovery
-
R. Crossley Thematic analysis: a chemogenomic approach to GPCR drug discovery Curr. Top. Med. Chem. 2011
-
(2011)
Curr. Top. Med. Chem.
-
-
Crossley, R.1
-
4
-
-
10044266768
-
Generalization of a targeted library design protocol: Application to 5-HT7 receptor ligands
-
E. Nordling, and E. Homan Generalization of a targeted library design protocol: application to 5-HT7 receptor ligands J. Chem. Inf. Comput. Sci. 44 2004 2207 2215
-
(2004)
J. Chem. Inf. Comput. Sci.
, vol.44
, pp. 2207-2215
-
-
Nordling, E.1
Homan, E.2
-
5
-
-
33646497571
-
Rational design of GPCR-specific combinational libraries based on the concept of privileged substructures
-
T. Oprea, Wiley-VCH Verlag GmbH & Co.
-
N.P. Savchuk Rational design of GPCR-specific combinational libraries based on the concept of privileged substructures T. Oprea, Chemoinformatics in Drug Discovery 2005 Wiley-VCH Verlag GmbH & Co. 287 313
-
(2005)
Chemoinformatics in Drug Discovery
, pp. 287-313
-
-
Savchuk, N.P.1
-
6
-
-
67650753759
-
Definition of the G protein-coupled receptor transmembrane bundle binding pocket and calculation of receptor similarities for drug design
-
D.E. Gloriam Definition of the G protein-coupled receptor transmembrane bundle binding pocket and calculation of receptor similarities for drug design J. Med. Chem. 52 2009 4429 4442
-
(2009)
J. Med. Chem.
, vol.52
, pp. 4429-4442
-
-
Gloriam, D.E.1
-
7
-
-
84967387077
-
Small molecules for chemogenomicsbased drug discovery
-
E. Jacoby, Imperial College Press
-
E. Jacoby Small molecules for chemogenomicsbased drug discovery E. Jacoby, Chemogenomics Knowledge-based Approaches to Drug Discovery 2006 Imperial College Press 1 38
-
(2006)
Chemogenomics Knowledge-based Approaches to Drug Discovery
, pp. 1-38
-
-
Jacoby, E.1
-
8
-
-
0842304428
-
Recognition of privileged structures by G-protein coupled receptors
-
K. Bondensgaard Recognition of privileged structures by G-protein coupled receptors J. Med. Chem. 47 2004 888 899
-
(2004)
J. Med. Chem.
, vol.47
, pp. 888-899
-
-
Bondensgaard, K.1
-
9
-
-
79960566597
-
G protein-coupled receptor transmembrane binding pockets and their applications in GPCR research and drug discovery: A survey
-
N.A. Kratochwil G protein-coupled receptor transmembrane binding pockets and their applications in GPCR research and drug discovery: a survey Curr. Top. Med. Chem. 11 2011 1902 1924
-
(2011)
Curr. Top. Med. Chem.
, vol.11
, pp. 1902-1924
-
-
Kratochwil, N.A.1
-
10
-
-
65649104052
-
Sequence-derived three-dimensional pharmacophore models for G-protein-coupled receptors and their application in virtual screening
-
T. Klabunde Sequence-derived three-dimensional pharmacophore models for G-protein-coupled receptors and their application in virtual screening J. Med. Chem. 52 2009 2923 2932
-
(2009)
J. Med. Chem.
, vol.52
, pp. 2923-2932
-
-
Klabunde, T.1
-
11
-
-
0038024615
-
The G-protein-coupled receptors in the human genome form five main families. Phylogenetic analysis, paralogon groups, and fingerprints
-
R. Fredriksson The G-protein-coupled receptors in the human genome form five main families. Phylogenetic analysis, paralogon groups, and fingerprints Mol. Pharmacol. 63 2003 1256 1272
-
(2003)
Mol. Pharmacol.
, vol.63
, pp. 1256-1272
-
-
Fredriksson, R.1
-
12
-
-
84862777405
-
Structure of the human M2 muscarinic acetylcholine receptor bound to an antagonist
-
K. Haga Structure of the human M2 muscarinic acetylcholine receptor bound to an antagonist Nature 482 2012 547 551
-
(2012)
Nature
, vol.482
, pp. 547-551
-
-
Haga, K.1
-
13
-
-
84863115467
-
Structure and dynamics of the M3 muscarinic acetylcholine receptor
-
A.C. Kruse Structure and dynamics of the M3 muscarinic acetylcholine receptor Nature 482 2012 552 556
-
(2012)
Nature
, vol.482
, pp. 552-556
-
-
Kruse, A.C.1
-
14
-
-
84861096654
-
Crystal structure of the micro-opioid receptor bound to a morphinan antagonist
-
A. Manglik Crystal structure of the micro-opioid receptor bound to a morphinan antagonist Nature 2012
-
(2012)
Nature
-
-
Manglik, A.1
-
15
-
-
84861019261
-
Structure of the nociceptin/orphanin FQ receptor in complex with a peptide mimetic
-
A.A. Thompson Structure of the nociceptin/orphanin FQ receptor in complex with a peptide mimetic Nature 485 2012 395 399
-
(2012)
Nature
, vol.485
, pp. 395-399
-
-
Thompson, A.A.1
-
16
-
-
84861075468
-
Structure of the delta-opioid receptor bound to naltrindole
-
S. Granier Structure of the delta-opioid receptor bound to naltrindole Nature 485 2012 400 404
-
(2012)
Nature
, vol.485
, pp. 400-404
-
-
Granier, S.1
-
17
-
-
84857254248
-
Crystal structure of a lipid G protein-coupled receptor
-
M.A. Hanson Crystal structure of a lipid G protein-coupled receptor Science 335 2012 851 855
-
(2012)
Science
, vol.335
, pp. 851-855
-
-
Hanson, M.A.1
-
18
-
-
84862777742
-
Structure of the human kappa-opioid receptor in complex with JDTic
-
H. Wu Structure of the human kappa-opioid receptor in complex with JDTic Nature 485 2012 327 332
-
(2012)
Nature
, vol.485
, pp. 327-332
-
-
Wu, H.1
-
19
-
-
79960176452
-
Progress in structure based drug design for G protein-coupled receptors
-
M. Congreve Progress in structure based drug design for G protein-coupled receptors J. Med. Chem. 54 2011 4283 4311
-
(2011)
J. Med. Chem.
, vol.54
, pp. 4283-4311
-
-
Congreve, M.1
-
20
-
-
66149131771
-
Development and validation of a novel protein-ligand fingerprint to mine chemogenomic space: Application to G protein-coupled receptors and their ligands
-
N. Weill, and D. Rognan Development and validation of a novel protein-ligand fingerprint to mine chemogenomic space: application to G protein-coupled receptors and their ligands J. Chem. Inf. Model. 49 2009 1049 1062
-
(2009)
J. Chem. Inf. Model.
, vol.49
, pp. 1049-1062
-
-
Weill, N.1
Rognan, D.2
-
21
-
-
79960603508
-
Quantitative chemogenomics: Machine-learning models of protein-ligand interaction
-
C.R. Andersson Quantitative chemogenomics: machine-learning models of protein-ligand interaction Curr. Top. Med. Chem. 2011
-
(2011)
Curr. Top. Med. Chem.
-
-
Andersson, C.R.1
-
22
-
-
36949011636
-
The G protein-coupled receptor subset of the rat genome
-
338-338
-
D.E. Gloriam The G protein-coupled receptor subset of the rat genome BMC Genomics 8 2007 338-338
-
(2007)
BMC Genomics
, vol.8
-
-
Gloriam, D.E.1
-
23
-
-
75549090596
-
Structure-based chemogenomics: Analysis of protein family landscapes
-
B. Pirard Structure-based chemogenomics: analysis of protein family landscapes Methods Mol. Biol. 575 2009 281 296
-
(2009)
Methods Mol. Biol.
, vol.575
, pp. 281-296
-
-
Pirard, B.1
-
24
-
-
4344668661
-
Drug repositioning: Identifying and developing new uses for existing drugs
-
T.T. Ashburn, and K.B. Thor Drug repositioning: identifying and developing new uses for existing drugs Nat. Rev. Drug Discov. 3 2004 673 683
-
(2004)
Nat. Rev. Drug Discov.
, vol.3
, pp. 673-683
-
-
Ashburn, T.T.1
Thor, K.B.2
-
25
-
-
80051988079
-
Assay Related Target Similarity (ARTS)-chemogenomics approach for quantitative comparison of biological targets
-
M. Bieler Assay Related Target Similarity (ARTS)-chemogenomics approach for quantitative comparison of biological targets J. Chem. Inf. Model. 51 2011 1897 1905
-
(2011)
J. Chem. Inf. Model.
, vol.51
, pp. 1897-1905
-
-
Bieler, M.1
-
26
-
-
78649329699
-
Knowledge-based analysis of multi-potent G-protein coupled receptors ligands
-
P. Faure Knowledge-based analysis of multi-potent G-protein coupled receptors ligands Eur. J. Med. Chem. 2010
-
(2010)
Eur. J. Med. Chem.
-
-
Faure, P.1
-
27
-
-
33846538483
-
Target, chemical and bioactivity databases-integration is key
-
T.I. Oprea, and A. Tropsha Target, chemical and bioactivity databases-integration is key Drug Discov. Today: Technol. 3 2006 357 365
-
(2006)
Drug Discov. Today: Technol.
, vol.3
, pp. 357-365
-
-
Oprea, T.I.1
Tropsha, A.2
-
28
-
-
77953387346
-
Drug repositioning using in silico compound profiling
-
E. Dubus Drug repositioning using in silico compound profiling Fut. Med. Chem. 1 2009 1723 1736
-
(2009)
Fut. Med. Chem.
, vol.1
, pp. 1723-1736
-
-
Dubus, E.1
-
29
-
-
0024239320
-
Methods for drug discovery: Development of potent, selective, orally effective cholecystokinin antagonists
-
B.E. Evans Methods for drug discovery: development of potent, selective, orally effective cholecystokinin antagonists J. Med. Chem. 31 1988 2235 2246
-
(1988)
J. Med. Chem.
, vol.31
, pp. 2235-2246
-
-
Evans, B.E.1
-
30
-
-
36749018204
-
Privileged structures: A useful concept for the rational design of new lead drug candidates
-
C.D. Duarte Privileged structures: a useful concept for the rational design of new lead drug candidates Mini. Rev. Med. Chem. 7 2007 1108 1119
-
(2007)
Mini. Rev. Med. Chem.
, vol.7
, pp. 1108-1119
-
-
Duarte, C.D.1
-
31
-
-
82255194026
-
Chemogenomic discovery of allosteric antagonists at the GPRC6A receptor
-
D.E. Gloriam Chemogenomic discovery of allosteric antagonists at the GPRC6A receptor Chem. Biol. 18 2011 1489 1498
-
(2011)
Chem. Biol.
, vol.18
, pp. 1489-1498
-
-
Gloriam, D.E.1
-
32
-
-
79960611168
-
Chemogenomic approaches for the exploration of GPCR space
-
N. Weill Chemogenomic approaches for the exploration of GPCR space Curr. Top. Med. Chem. 2011
-
(2011)
Curr. Top. Med. Chem.
-
-
Weill, N.1
-
33
-
-
79952520897
-
Proteochemometric modeling as a tool to design selective compounds and for extrapolating to novel targets
-
G.J.P. van Westen Proteochemometric modeling as a tool to design selective compounds and for extrapolating to novel targets MedChemComm 2 2011 16 30
-
(2011)
MedChemComm
, vol.2
, pp. 16-30
-
-
Van Westen, G.J.P.1
-
34
-
-
52749098733
-
Virtual screening of GPCRs: An in silico chemogenomics approach
-
L. Jacob Virtual screening of GPCRs: an in silico chemogenomics approach BMC Bioinformatics 9 2008 363
-
(2008)
BMC Bioinformatics
, vol.9
, pp. 363
-
-
Jacob, L.1
-
35
-
-
14944341203
-
Deorphanization of GPRC6A: A promiscuous L-alpha-amino acid receptor with preference for basic amino acids
-
P. Wellendorph Deorphanization of GPRC6A: a promiscuous L-alpha-amino acid receptor with preference for basic amino acids Mol. Pharmacol. 67 2005 589 597
-
(2005)
Mol. Pharmacol.
, vol.67
, pp. 589-597
-
-
Wellendorph, P.1
-
36
-
-
0034878886
-
A novel chemogenomics knowledge-based ligand design strategy-application to G protein-coupled receptors
-
E. Jacoby A novel chemogenomics knowledge-based ligand design strategy-application to G protein-coupled receptors Quant. Struct.-Act. Relationship 20 2001 115 123
-
(2001)
Quant. Struct.-Act. Relationship
, vol.20
, pp. 115-123
-
-
Jacoby, E.1
-
37
-
-
77957055780
-
Integrated methods for the construction of three-dimensional models and computational probing of structure-function relations in G protein-coupled receptors
-
J.A. Ballesteros, and H. Weinstein Integrated methods for the construction of three-dimensional models and computational probing of structure-function relations in G protein-coupled receptors Methods Neurosci. 25 1995 366 428
-
(1995)
Methods Neurosci.
, vol.25
, pp. 366-428
-
-
Ballesteros, J.A.1
Weinstein, H.2
-
38
-
-
79960606839
-
A ligand's view of target similarity: Chemogenomic binding site-directed techniques for drug discovery
-
S.L. Garland, and D.E. Gloriam A ligand's view of target similarity: chemogenomic binding site-directed techniques for drug discovery Curr. Top. Med. Chem. 2011
-
(2011)
Curr. Top. Med. Chem.
-
-
Garland, S.L.1
Gloriam, D.E.2
-
39
-
-
84862291381
-
A prospective cross-screening study on G-protein-coupled receptors: Lessons learned in virtual compound library design
-
M.P. Sanders A prospective cross-screening study on G-protein-coupled receptors: lessons learned in virtual compound library design J. Med. Chem. 2012
-
(2012)
J. Med. Chem.
-
-
Sanders, M.P.1
-
40
-
-
80051937251
-
Fragment library screening reveals remarkable similarities between the G protein-coupled receptor histamine H(4) and the ion channel serotonin 5-HT(3)A
-
M.H. Verheij Fragment library screening reveals remarkable similarities between the G protein-coupled receptor histamine H(4) and the ion channel serotonin 5-HT(3)A Bioorg. Med. Chem. Lett. 21 2011 5460 5464
-
(2011)
Bioorg. Med. Chem. Lett.
, vol.21
, pp. 5460-5464
-
-
Verheij, M.H.1
|