Compile Data Set for Download or QSAR

Found 432 hits with Last Name = 'krishnamurthy' and Initial = 'g'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28104 (3-cyanoquinoline, 29 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCN1CCN(CCCOc2cc3ncc(C#N)c(Nc4ccc(Sc5nc(C)c(C)n5CC)c(Cl)c4)c3cc2OC)CC1 Show InChI InChI=1S/C33H40ClN7O2S/c1-6-39-12-14-40(15-13-39)11-8-16-43-30-19-28-26(18-29(30)42-5)32(24(20-35)21-36-28)38-25-9-10-31(27(34)17-25)44-33-37-22(3)23(4)41(33)7-2/h9-10,17-19,21H,6-8,11-16H2,1-5H3,(H,36,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28091 (3-cyanoquinoline, 16 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(NCCCN(C)C)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C29H34ClN7OS/c1-7-37-19(3)18(2)34-29(37)39-27-10-9-21(13-23(27)30)35-28-20(16-31)17-33-24-15-25(26(38-6)14-22(24)28)32-11-8-12-36(4)5/h9-10,13-15,17,32H,7-8,11-12H2,1-6H3,(H,33,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28105 (3-cyanoquinoline, 30 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCN4CCN(CCO)CC4)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C33H40ClN7O3S/c1-5-41-23(3)22(2)37-33(41)45-31-8-7-25(17-27(31)34)38-32-24(20-35)21-36-28-19-30(29(43-4)18-26(28)32)44-16-6-9-39-10-12-40(13-11-39)14-15-42/h7-8,17-19,21,42H,5-6,9-16H2,1-4H3,(H,36,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28112 (3-cyanoquinoline, 37 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCN(C)CCC4OCCO4)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C33H39ClN6O4S/c1-6-40-22(3)21(2)37-33(40)45-30-9-8-24(16-26(30)34)38-32-23(19-35)20-36-27-18-29(28(41-5)17-25(27)32)42-13-7-11-39(4)12-10-31-43-14-15-44-31/h8-9,16-18,20,31H,6-7,10-15H2,1-5H3,(H,36,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28110 (3-cyanoquinoline, 35 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCN(C)CC(O)CO)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C31H37ClN6O4S/c1-6-38-20(3)19(2)35-31(38)43-29-9-8-22(12-25(29)32)36-30-21(15-33)16-34-26-14-28(27(41-5)13-24(26)30)42-11-7-10-37(4)17-23(40)18-39/h8-9,12-14,16,23,39-40H,6-7,10-11,17-18H2,1-5H3,(H,34,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28106 (3-cyanoquinoline, 31 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCN(C)CCO)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C30H35ClN6O3S/c1-6-37-20(3)19(2)34-30(37)41-28-9-8-22(14-24(28)31)35-29-21(17-32)18-33-25-16-27(26(39-5)15-23(25)29)40-13-7-10-36(4)11-12-38/h8-9,14-16,18,38H,6-7,10-13H2,1-5H3,(H,33,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28111 (3-cyanoquinoline, 36 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCN4CCOCC4)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C31H35ClN6O3S/c1-5-38-21(3)20(2)35-31(38)42-29-8-7-23(15-25(29)32)36-30-22(18-33)19-34-26-17-28(27(39-4)16-24(26)30)41-12-6-9-37-10-13-40-14-11-37/h7-8,15-17,19H,5-6,9-14H2,1-4H3,(H,34,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28114 (3-cyanoquinoline, 39 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCN4CCN(CC4)C(C)=O)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C33H38ClN7O3S/c1-6-41-22(3)21(2)37-33(41)45-31-9-8-25(16-27(31)34)38-32-24(19-35)20-36-28-18-30(29(43-5)17-26(28)32)44-15-7-10-39-11-13-40(14-12-39)23(4)42/h8-9,16-18,20H,6-7,10-15H2,1-5H3,(H,36,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28115 (3-cyanoquinoline, 40 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(NCCCN4CCN(C)CC4)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C32H39ClN8OS/c1-6-41-22(3)21(2)37-32(41)43-30-9-8-24(16-26(30)33)38-31-23(19-34)20-36-27-18-28(29(42-5)17-25(27)31)35-10-7-11-40-14-12-39(4)13-15-40/h8-9,16-18,20,35H,6-7,10-15H2,1-5H3,(H,36,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28109 (3-cyanoquinoline, 34 | {2-[4-(3-{[4-({3-chloro-4-[...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCN4CCN(CCOC(N)=O)CC4)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C34H41ClN8O4S/c1-5-43-23(3)22(2)39-34(43)48-31-8-7-25(17-27(31)35)40-32-24(20-36)21-38-28-19-30(29(45-4)18-26(28)32)46-15-6-9-41-10-12-42(13-11-41)14-16-47-33(37)44/h7-8,17-19,21H,5-6,9-16H2,1-4H3,(H2,37,44)(H,38,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28107 (3-cyanoquinoline, 32 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCN4CCC(O)C4)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C31H35ClN6O3S/c1-5-38-20(3)19(2)35-31(38)42-29-8-7-22(13-25(29)32)36-30-21(16-33)17-34-26-15-28(27(40-4)14-24(26)30)41-12-6-10-37-11-9-23(39)18-37/h7-8,13-15,17,23,39H,5-6,9-12,18H2,1-4H3,(H,34,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265554 ((2S)-N-(tert-Butyl)-2-{[4-({[5-(phenylsulfonyl)-2-...) Show SMILES CC(C)(C)NC(=O)N1CCC[C@H]1C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C28H35F3N4O6S2/c1-27(2,3)32-26(37)35-15-7-10-23(35)25(36)34-16-13-19(14-17-34)33-43(40,41)24-18-21(11-12-22(24)28(29,30)31)42(38,39)20-8-5-4-6-9-20/h4-6,8-9,11-12,18-19,23,33H,7,10,13-17H2,1-3H3,(H,32,37)/t23-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50308710 (3-{[4-({[5-(Phenylsulfonyl)-2-(trifluoromethyl)phe...) Show SMILES OC(=O)c1cccc(c1)S(=O)(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C25H23F3N2O8S3/c26-25(27,28)22-10-9-20(39(33,34)19-6-2-1-3-7-19)16-23(22)40(35,36)29-18-11-13-30(14-12-18)41(37,38)21-8-4-5-17(15-21)24(31)32/h1-10,15-16,18,29H,11-14H2,(H,31,32)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of fluorescence probe compound from human SFRP1 after 30 mins by fluorescence polarization assay				Bioorg Med Chem 18: 190-201 (2010) Article DOI: 10.1016/j.bmc.2009.11.002 BindingDB Entry DOI: 10.7270/Q2PZ58Z7
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28095 (3-cyanoquinoline, 20 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(NCCCN4CCOCC4)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C31H36ClN7O2S/c1-5-39-21(3)20(2)36-31(39)42-29-8-7-23(15-25(29)32)37-30-22(18-33)19-35-26-17-27(28(40-4)16-24(26)30)34-9-6-10-38-11-13-41-14-12-38/h7-8,15-17,19,34H,5-6,9-14H2,1-4H3,(H,35,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50308711 (4-{[4-({[5-(Phenylsulfonyl)-2-(trifluoromethyl)phe...) Show SMILES OC(=O)c1ccc(cc1)S(=O)(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C25H23F3N2O8S3/c26-25(27,28)22-11-10-21(39(33,34)19-4-2-1-3-5-19)16-23(22)40(35,36)29-18-12-14-30(15-13-18)41(37,38)20-8-6-17(7-9-20)24(31)32/h1-11,16,18,29H,12-15H2,(H,31,32)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of fluorescence probe compound from human SFRP1 after 30 mins by fluorescence polarization assay				Bioorg Med Chem 18: 190-201 (2010) Article DOI: 10.1016/j.bmc.2009.11.002 BindingDB Entry DOI: 10.7270/Q2PZ58Z7
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265547 (CHEMBL455476 | N-{1-[1-(3,3-Dimethylbutanoyl)-L-pr...) Show SMILES CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C29H36F3N3O6S2/c1-28(2,3)19-26(36)35-15-7-10-24(35)27(37)34-16-13-20(14-17-34)33-43(40,41)25-18-22(11-12-23(25)29(30,31)32)42(38,39)21-8-5-4-6-9-21/h4-6,8-9,11-12,18,20,24,33H,7,10,13-17,19H2,1-3H3/t24-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265555 ((2S)-N-Phenyl-2-{[4-({[5-(phenylsulfonyl)-2-(trifl...) Show SMILES FC(F)(F)c1ccc(cc1S(=O)(=O)NC1CCN(CC1)C(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C30H31F3N4O6S2/c31-30(32,33)25-14-13-24(44(40,41)23-10-5-2-6-11-23)20-27(25)45(42,43)35-22-15-18-36(19-16-22)28(38)26-12-7-17-37(26)29(39)34-21-8-3-1-4-9-21/h1-6,8-11,13-14,20,22,26,35H,7,12,15-19H2,(H,34,39)/t26-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28098 (3-cyanoquinoline, 23 | 7-{3-[tert-butyl(2-hydroxye...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCN(CCO)C(C)(C)C)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C33H41ClN6O3S/c1-8-40-22(3)21(2)37-32(40)44-30-11-10-24(16-26(30)34)38-31-23(19-35)20-36-27-18-29(28(42-7)17-25(27)31)43-15-9-12-39(13-14-41)33(4,5)6/h10-11,16-18,20,41H,8-9,12-15H2,1-7H3,(H,36,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28096 (3-cyanoquinoline, 21 | 7-({3-[bis(2-hydroxyethyl)a...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(NCCCN(CCO)CCO)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C31H38ClN7O3S/c1-5-39-21(3)20(2)36-31(39)43-29-8-7-23(15-25(29)32)37-30-22(18-33)19-35-26-17-27(28(42-4)16-24(26)30)34-9-6-10-38(11-13-40)12-14-41/h7-8,15-17,19,34,40-41H,5-6,9-14H2,1-4H3,(H,35,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28088 (3-cyanoquinoline, 13 | 4-({3-chloro-4-[(1,4,5-trim...) Show SMILES COc1cc2c(Nc3ccc(Sc4nc(C)c(C)n4C)c(Cl)c3)c(cnc2cc1NCCCN(C)C)C#N Show InChI InChI=1S/C28H32ClN7OS/c1-17-18(2)36(5)28(33-17)38-26-9-8-20(12-22(26)29)34-27-19(15-30)16-32-23-14-24(25(37-6)13-21(23)27)31-10-7-11-35(3)4/h8-9,12-14,16,31H,7,10-11H2,1-6H3,(H,32,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265499 (CHEMBL495534 | N-[1-(1H-Imidazol-1-ylacetyl)piperi...) Show SMILES FC(F)(F)c1ccc(cc1S(=O)(=O)NC1CCN(CC1)C(=O)Cn1ccnc1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C23H23F3N4O5S2/c24-23(25,26)20-7-6-19(36(32,33)18-4-2-1-3-5-18)14-21(20)37(34,35)28-17-8-11-30(12-9-17)22(31)15-29-13-10-27-16-29/h1-7,10,13-14,16-17,28H,8-9,11-12,15H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28099 (3-cyanoquinoline, 24 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCN(C)C)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C29H33ClN6O2S/c1-7-36-19(3)18(2)33-29(36)39-27-10-9-21(13-23(27)30)34-28-20(16-31)17-32-24-15-26(25(37-6)14-22(24)28)38-12-8-11-35(4)5/h9-10,13-15,17H,7-8,11-12H2,1-6H3,(H,32,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28092 (3-cyanoquinoline, 17 | 4-({3-bromo-4-[(1,4,5-trime...) Show SMILES COc1cc2c(Nc3ccc(Sc4nc(C)c(C)n4C)c(Br)c3)c(cnc2cc1NCCCN(C)C)C#N Show InChI InChI=1S/C28H32BrN7OS/c1-17-18(2)36(5)28(33-17)38-26-9-8-20(12-22(26)29)34-27-19(15-30)16-32-23-14-24(25(37-6)13-21(23)27)31-10-7-11-35(3)4/h8-9,12-14,16,31H,7,10-11H2,1-6H3,(H,32,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50308712 (5-(Phenylsulfonyl)-N-(1-{[3-(2H-tetrazol-5-yl)phen...) Show SMILES FC(F)(F)c1ccc(cc1S(=O)(=O)NC1CCN(CC1)S(=O)(=O)c1cccc(c1)-c1nnn[nH]1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C25H23F3N6O6S3/c26-25(27,28)22-10-9-20(41(35,36)19-6-2-1-3-7-19)16-23(22)42(37,38)31-18-11-13-34(14-12-18)43(39,40)21-8-4-5-17(15-21)24-29-32-33-30-24/h1-10,15-16,18,31H,11-14H2,(H,29,30,32,33)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of fluorescence probe compound from human SFRP1 after 30 mins by fluorescence polarization assay				Bioorg Med Chem 18: 190-201 (2010) Article DOI: 10.1016/j.bmc.2009.11.002 BindingDB Entry DOI: 10.7270/Q2PZ58Z7
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265583 (CHEMBL451431 | N-{1-[1-(3,3-Dimethylbutyl)-L-proly...) Show SMILES CC(C)(C)CCN1CCC[C@H]1C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C29H38F3N3O5S2/c1-28(2,3)15-19-34-16-7-10-25(34)27(36)35-17-13-21(14-18-35)33-42(39,40)26-20-23(11-12-24(26)29(30,31)32)41(37,38)22-8-5-4-6-9-22/h4-6,8-9,11-12,20-21,25,33H,7,10,13-19H2,1-3H3/t25-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265580 ((2S)-N,N-Dimethyl-2-{[4-({[5-(phenylsulfonyl)-2-(t...) Show SMILES CN(C)C(=O)N1CCC[C@H]1C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C26H31F3N4O6S2/c1-31(2)25(35)33-14-6-9-22(33)24(34)32-15-12-18(13-16-32)30-41(38,39)23-17-20(10-11-21(23)26(27,28)29)40(36,37)19-7-4-3-5-8-19/h3-5,7-8,10-11,17-18,22,30H,6,9,12-16H2,1-2H3/t22-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265553 ((2S)-N-Ethyl-2-{[4-({[5-(phenylsulfonyl)-2-(triflu...) Show SMILES CCNC(=O)N1CCC[C@H]1C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C26H31F3N4O6S2/c1-2-30-25(35)33-14-6-9-22(33)24(34)32-15-12-18(13-16-32)31-41(38,39)23-17-20(10-11-21(23)26(27,28)29)40(36,37)19-7-4-3-5-8-19/h3-5,7-8,10-11,17-18,22,31H,2,6,9,12-16H2,1H3,(H,30,35)/t22-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28103 (3-cyanoquinoline, 28 | N-(3-{[4-({3-chloro-4-[(1-e...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCNS(C)(=O)=O)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C28H31ClN6O4S2/c1-6-35-18(3)17(2)33-28(35)40-26-9-8-20(12-22(26)29)34-27-19(15-30)16-31-23-14-25(24(38-4)13-21(23)27)39-11-7-10-32-41(5,36)37/h8-9,12-14,16,32H,6-7,10-11H2,1-5H3,(H,31,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28101 (3-cyanoquinoline, 26 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCC1CCCCN1CCCOc1cc2ncc(C#N)c(Nc3ccc(Sc4nc(C)c(C)n4CC)c(Cl)c3)c2cc1OC Show InChI InChI=1S/C34H41ClN6O2S/c1-6-26-11-8-9-14-40(26)15-10-16-43-31-19-29-27(18-30(31)42-5)33(24(20-36)21-37-29)39-25-12-13-32(28(35)17-25)44-34-38-22(3)23(4)41(34)7-2/h12-13,17-19,21,26H,6-11,14-16H2,1-5H3,(H,37,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50308692 (CHEMBL606033 | N-(1-{[6-(Dimethylamino)pyridin-3-y...) Show SMILES CN(C)c1ccc(cn1)C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C26H27F3N4O5S2/c1-32(2)24-11-8-18(17-30-24)25(34)33-14-12-19(13-15-33)31-40(37,38)23-16-21(9-10-22(23)26(27,28)29)39(35,36)20-6-4-3-5-7-20/h3-11,16-17,19,31H,12-15H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of fluorescence probe compound from human SFRP1 after 30 mins by fluorescence polarization assay				Bioorg Med Chem 18: 190-201 (2010) Article DOI: 10.1016/j.bmc.2009.11.002 BindingDB Entry DOI: 10.7270/Q2PZ58Z7
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265546 (CHEMBL447079 | N-{1-[1-(2,2-Dimethylpropanoyl)-L-p...) Show SMILES CC(C)(C)C(=O)N1CCC[C@H]1C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C28H34F3N3O6S2/c1-27(2,3)26(36)34-15-7-10-23(34)25(35)33-16-13-19(14-17-33)32-42(39,40)24-18-21(11-12-22(24)28(29,30)31)41(37,38)20-8-5-4-6-9-20/h4-6,8-9,11-12,18-19,23,32H,7,10,13-17H2,1-3H3/t23-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
3-phosphoinositide-dependent protein kinase 1 (Homo sapiens (Human))	BDBM19091 (9-amino-15,16-dimethoxy-6-methyl-8,12-diazatetracy...) Show SMILES COc1cc2ncc3c(N)nc4c(C)c(O)ccc4c3c2cc1OC Show InChI InChI=1S/C19H17N3O3/c1-9-14(23)5-4-10-17-11-6-15(24-2)16(25-3)7-13(11)21-8-12(17)19(20)22-18(9)10/h4-8,23H,1-3H3,(H2,20,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	7.4	23
Wyeth Research					Assay Description A homogeneous in vitro assay based on a LANCE format was first used for high-throughput screening. Those compounds that showed the largest different...				J Med Chem 50: 5547-9 (2007) Article DOI: 10.1021/jm070851i BindingDB Entry DOI: 10.7270/Q2639N0S
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265545 (CHEMBL500903 | N-[1-(1-Isobutyryl-L-prolyl)piperid...) Show SMILES CC(C)C(=O)N1CCC[C@H]1C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C27H32F3N3O6S2/c1-18(2)25(34)33-14-6-9-23(33)26(35)32-15-12-19(13-16-32)31-41(38,39)24-17-21(10-11-22(24)27(28,29)30)40(36,37)20-7-4-3-5-8-20/h3-5,7-8,10-11,17-19,23,31H,6,9,12-16H2,1-2H3/t23-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265581 (CHEMBL505036 | N-{1-[1-(Morpholin-4-ylcarbonyl)-L-...) Show SMILES FC(F)(F)c1ccc(cc1S(=O)(=O)NC1CCN(CC1)C(=O)[C@@H]1CCCN1C(=O)N1CCOCC1)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C28H33F3N4O7S2/c29-28(30,31)23-9-8-22(43(38,39)21-5-2-1-3-6-21)19-25(23)44(40,41)32-20-10-13-33(14-11-20)26(36)24-7-4-12-35(24)27(37)34-15-17-42-18-16-34/h1-3,5-6,8-9,19-20,24,32H,4,7,10-18H2/t24-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50308701 (5-(Phenylsulfonyl)-N-{1-[(3S)-pyrrolidin-3-ylcarbo...) Show SMILES FC(F)(F)c1ccc(cc1S(=O)(=O)NC1CCN(CC1)C(=O)[C@H]1CCNC1)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C23H26F3N3O5S2/c24-23(25,26)20-7-6-19(35(31,32)18-4-2-1-3-5-18)14-21(20)36(33,34)28-17-9-12-29(13-10-17)22(30)16-8-11-27-15-16/h1-7,14,16-17,27-28H,8-13,15H2/t16-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of fluorescence probe compound from human SFRP1 after 30 mins by fluorescence polarization assay				Bioorg Med Chem 18: 190-201 (2010) Article DOI: 10.1016/j.bmc.2009.11.002 BindingDB Entry DOI: 10.7270/Q2PZ58Z7
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265584 (CHEMBL503281 | N-{1-[1-(Cyclohexylmethyl)-L-prolyl...) Show SMILES FC(F)(F)c1ccc(cc1S(=O)(=O)NC1CCN(CC1)C(=O)[C@@H]1CCCN1CC1CCCCC1)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C30H38F3N3O5S2/c31-30(32,33)26-14-13-25(42(38,39)24-10-5-2-6-11-24)20-28(26)43(40,41)34-23-15-18-35(19-16-23)29(37)27-12-7-17-36(27)21-22-8-3-1-4-9-22/h2,5-6,10-11,13-14,20,22-23,27,34H,1,3-4,7-9,12,15-19,21H2/t27-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM29511 (Pyranonaphthoquinone (PNQ) lactone, 11a) Show SMILES O=C1C[C@H]2OCC3=C([C@H]2O1)C(=O)c1ccccc1C3=O |r,c:6| Show InChI InChI=1S/C15H10O5/c16-11-5-10-15(20-11)12-9(6-19-10)13(17)7-3-1-2-4-8(7)14(12)18/h1-4,10,15H,5-6H2/t10-,15+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	7.4	22
Wyeth Research					Assay Description AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...				J Med Chem 52: 2181-4 (2009) Article DOI: 10.1021/jm900075g BindingDB Entry DOI: 10.7270/Q2V69GW9
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28100 (3-cyanoquinoline, 25 | 4-(3-{[4-({3-chloro-4-[(1-e...) Show SMILES CCNC(=O)N1CCN(CCCOc2cc3ncc(C#N)c(Nc4ccc(Sc5nc(C)c(C)n5CC)c(Cl)c4)c3cc2OC)CC1 Show InChI InChI=1S/C34H41ClN8O3S/c1-6-37-33(44)42-14-12-41(13-15-42)11-8-16-46-30-19-28-26(18-29(30)45-5)32(24(20-36)21-38-28)40-25-9-10-31(27(35)17-25)47-34-39-22(3)23(4)43(34)7-2/h9-10,17-19,21H,6-8,11-16H2,1-5H3,(H,37,44)(H,38,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	7.5	22
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28113 (3-cyanoquinoline, 38 | 4-({3-chloro-4-[(1-ethyl-4,...) Show SMILES CCn1c(C)c(C)nc1Sc1ccc(Nc2c(cnc3cc(OCCCN4CCC(O)CC4)c(OC)cc23)C#N)cc1Cl Show InChI InChI=1S/C32H37ClN6O3S/c1-5-39-21(3)20(2)36-32(39)43-30-8-7-23(15-26(30)33)37-31-22(18-34)19-35-27-17-29(28(41-4)16-25(27)31)42-14-6-11-38-12-9-24(40)10-13-38/h7-8,15-17,19,24,40H,5-6,9-14H2,1-4H3,(H,35,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50308698 (CHEMBL600050 | tert-Butyl(3R)-3-{[4-({[5-(phenylsu...) Show SMILES CC(C)(C)OC(=O)N1CC[C@H](C1)C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C28H34F3N3O7S2/c1-27(2,3)41-26(36)34-14-11-19(18-34)25(35)33-15-12-20(13-16-33)32-43(39,40)24-17-22(9-10-23(24)28(29,30)31)42(37,38)21-7-5-4-6-8-21/h4-10,17,19-20,32H,11-16,18H2,1-3H3/t19-/m1/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of fluorescence probe compound from human SFRP1 after 30 mins by fluorescence polarization assay				Bioorg Med Chem 18: 190-201 (2010) Article DOI: 10.1016/j.bmc.2009.11.002 BindingDB Entry DOI: 10.7270/Q2PZ58Z7
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265549 (CHEMBL507695 | N-{1-[1-(Cyclohexylcarbonyl)-L-prol...) Show SMILES FC(F)(F)c1ccc(cc1S(=O)(=O)NC1CCN(CC1)C(=O)[C@@H]1CCCN1C(=O)C1CCCCC1)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C30H36F3N3O6S2/c31-30(32,33)25-14-13-24(43(39,40)23-10-5-2-6-11-23)20-27(25)44(41,42)34-22-15-18-35(19-16-22)29(38)26-12-7-17-36(26)28(37)21-8-3-1-4-9-21/h2,5-6,10-11,13-14,20-22,26,34H,1,3-4,7-9,12,15-19H2/t26-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50308691 (5-(Phenylsulfonyl)-2-(trifluoromethyl)-N-(1-{[6-(t...) Show SMILES FC(F)(F)c1ccc(cn1)C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C25H21F6N3O5S2/c26-24(27,28)20-8-7-19(40(36,37)18-4-2-1-3-5-18)14-21(20)41(38,39)33-17-10-12-34(13-11-17)23(35)16-6-9-22(32-15-16)25(29,30)31/h1-9,14-15,17,33H,10-13H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of fluorescence probe compound from human SFRP1 after 30 mins by fluorescence polarization assay				Bioorg Med Chem 18: 190-201 (2010) Article DOI: 10.1016/j.bmc.2009.11.002 BindingDB Entry DOI: 10.7270/Q2PZ58Z7
					More data for this Ligand-Target Pair
Insulin-like growth factor 1 receptor (Homo sapiens (Human))	BDBM28118 (3-cyanoquinoline, 3 | 4-({3-chloro-4-[(1-methyl-1H...) Show SMILES CCN1CCN(CCCOc2cc3ncc(C#N)c(Nc4ccc(Sc5nccn5C)c(Cl)c4)c3cc2OC)CC1 Show InChI InChI=1S/C30H34ClN7O2S/c1-4-37-11-13-38(14-12-37)9-5-15-40-27-18-25-23(17-26(27)39-3)29(21(19-32)20-34-25)35-22-6-7-28(24(31)16-22)41-30-33-8-10-36(30)2/h6-8,10,16-18,20H,4-5,9,11-15H2,1-3H3,(H,34,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description Assays were performed in microtiter plates in reaction buffer containing biotinylated substrate, ATP, and purified kinase in the presence of test com...				Bioorg Med Chem Lett 19: 62-6 (2009) Article DOI: 10.1016/j.bmcl.2008.11.037 BindingDB Entry DOI: 10.7270/Q2M32T38
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM29512 (Pyranonaphthoquinone (PNQ) lactone, 11b) Show SMILES O=C1C[C@H]2O[C@H](c3cccs3)C3=C([C@H]2O1)C(=O)c1ccccc1C3=O |r,c:12| Show InChI InChI=1S/C19H12O5S/c20-13-8-11-18(24-13)14-15(19(23-11)12-6-3-7-25-12)17(22)10-5-2-1-4-9(10)16(14)21/h1-7,11,18-19H,8H2/t11-,18+,19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	7.4	22
Wyeth Research					Assay Description AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...				J Med Chem 52: 2181-4 (2009) Article DOI: 10.1021/jm900075g BindingDB Entry DOI: 10.7270/Q2V69GW9
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50308702 (5-(Phenylsulfonyl)-N-{1-[(3R)-pyrrolidin-3-ylcarbo...) Show SMILES FC(F)(F)c1ccc(cc1S(=O)(=O)NC1CCN(CC1)C(=O)[C@@H]1CCNC1)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C23H26F3N3O5S2/c24-23(25,26)20-7-6-19(35(31,32)18-4-2-1-3-5-18)14-21(20)36(33,34)28-17-9-12-29(13-10-17)22(30)16-8-11-27-15-16/h1-7,14,16-17,27-28H,8-13,15H2/t16-/m1/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of fluorescence probe compound from human SFRP1 after 30 mins by fluorescence polarization assay				Bioorg Med Chem 18: 190-201 (2010) Article DOI: 10.1016/j.bmc.2009.11.002 BindingDB Entry DOI: 10.7270/Q2PZ58Z7
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265500 ((S)-tert-butyl 2-(4-(5-(phenylsulfonyl)-2-(trifluo...) Show SMILES CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C28H34F3N3O7S2/c1-27(2,3)41-26(36)34-15-7-10-23(34)25(35)33-16-13-19(14-17-33)32-43(39,40)24-18-21(11-12-22(24)28(29,30)31)42(37,38)20-8-5-4-6-9-20/h4-6,8-9,11-12,18-19,23,32H,7,10,13-17H2,1-3H3/t23-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of fluorescence probe compound from human SFRP1 after 30 mins by fluorescence polarization assay				Bioorg Med Chem 18: 190-201 (2010) Article DOI: 10.1016/j.bmc.2009.11.002 BindingDB Entry DOI: 10.7270/Q2PZ58Z7
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50308688 (5-(Phenylsulfonyl)-N-[1-(pyridin-3-ylcarbonyl)pipe...) Show SMILES FC(F)(F)c1ccc(cc1S(=O)(=O)NC1CCN(CC1)C(=O)c1ccccn1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C24H22F3N3O5S2/c25-24(26,27)20-10-9-19(36(32,33)18-6-2-1-3-7-18)16-22(20)37(34,35)29-17-11-14-30(15-12-17)23(31)21-8-4-5-13-28-21/h1-10,13,16-17,29H,11-12,14-15H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of fluorescence probe compound from human SFRP1 after 30 mins by fluorescence polarization assay				Bioorg Med Chem 18: 190-201 (2010) Article DOI: 10.1016/j.bmc.2009.11.002 BindingDB Entry DOI: 10.7270/Q2PZ58Z7
					More data for this Ligand-Target Pair
3-phosphoinositide-dependent protein kinase 1 (Homo sapiens (Human))	BDBM19087 (15,16-dimethoxy-6-methyl-8,12-diazatetracyclo[8.8....) Show SMILES COc1cc2ncc3c(N)nc4c(C)c(N)ccc4c3c2cc1OC Show InChI InChI=1S/C19H18N4O2/c1-9-13(20)5-4-10-17-11-6-15(24-2)16(25-3)7-14(11)22-8-12(17)19(21)23-18(9)10/h4-8H,20H2,1-3H3,(H2,21,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	DrugBank MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	7.4	23
Wyeth Research					Assay Description A homogeneous in vitro assay based on a LANCE format was first used for high-throughput screening. Those compounds that showed the largest different...				J Med Chem 50: 5547-9 (2007) Article DOI: 10.1021/jm070851i BindingDB Entry DOI: 10.7270/Q2639N0S
					More data for this Ligand-Target Pair				3D Structure (crystal)
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50308703 (2-[4-({[5-(Phenylsulfonyl)-2-(trifluoromethyl)phen...) Show SMILES NC(=O)CN1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C20H22F3N3O5S2/c21-20(22,23)17-7-6-16(32(28,29)15-4-2-1-3-5-15)12-18(17)33(30,31)25-14-8-10-26(11-9-14)13-19(24)27/h1-7,12,14,25H,8-11,13H2,(H2,24,27)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of fluorescence probe compound from human SFRP1 after 30 mins by fluorescence polarization assay				Bioorg Med Chem 18: 190-201 (2010) Article DOI: 10.1016/j.bmc.2009.11.002 BindingDB Entry DOI: 10.7270/Q2PZ58Z7
					More data for this Ligand-Target Pair
Secreted frizzled-related protein 1 (Homo sapiens (Human))	BDBM50265500 ((S)-tert-butyl 2-(4-(5-(phenylsulfonyl)-2-(trifluo...) Show SMILES CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C28H34F3N3O7S2/c1-27(2,3)41-26(36)34-15-7-10-23(34)25(35)33-16-13-19(14-17-33)32-43(39,40)24-18-21(11-12-22(24)28(29,30)31)42(37,38)20-8-5-4-6-9-20/h4-6,8-9,11-12,18-19,23,32H,7,10,13-17H2,1-3H3/t23-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Binding affinity to human purified SARP2 by fluorescent polarization assay				J Med Chem 52: 105-16 (2009) Article DOI: 10.1021/jm801144h BindingDB Entry DOI: 10.7270/Q2NZ87HT
					More data for this Ligand-Target Pair

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