Compile Data Set for Download or QSAR

Found 296 hits with Last Name = 'gong' and Initial = 'b'   

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
Serine/threonine-protein kinase B-raf (Homo sapiens (Human))	BDBM25391 (CHEMBL200622 | SB-590885 | SB590885 | [2-(4-{4-[(1...) Show SMILES CN(C)CCOc1ccc(cc1)-c1nc(c([nH]1)-c1ccc2C(CCc2c1)N=O)-c1ccncc1 Show InChI InChI=1S/C27H27N5O2/c1-32(2)15-16-34-22-7-3-19(4-8-22)27-29-25(18-11-13-28-14-12-18)26(30-27)21-5-9-23-20(17-21)6-10-24(23)31-33/h3-5,7-9,11-14,17,24H,6,10,15-16H2,1-2H3,(H,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	0.160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of BRAF				Bioorg Med Chem 20: 3746-55 (2012) Article DOI: 10.1016/j.bmc.2012.04.047 BindingDB Entry DOI: 10.7270/Q2QF8TXP
					More data for this Ligand-Target Pair				3D Structure (crystal)
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141250 (CHEMBL34896 | [4-Chloro-3-(5-chloro-benzothiazol-2...) Show SMILES Clc1ccc2sc(nc2c1)-c1cc(NC(=O)OCC#C)ccc1Cl Show InChI InChI=1S/C17H10Cl2N2O2S/c1-2-7-23-17(22)20-11-4-5-13(19)12(9-11)16-21-14-8-10(18)3-6-15(14)24-16/h1,3-6,8-9H,7H2,(H,20,22)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144730 (6-(5-Chloro-2-ethoxy-phenyl)-N*4*-(4-nitro-phenyl)...) Show SMILES CCOc1ccc(Cl)cc1-c1cc(Nc2ccc(cc2)[N+]([O-])=O)nc(N)n1 Show InChI InChI=1S/C18H16ClN5O3/c1-2-27-16-8-3-11(19)9-14(16)15-10-17(23-18(20)22-15)21-12-4-6-13(7-5-12)24(25)26/h3-10H,2H2,1H3,(H3,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141306 (CHEMBL286394 | N-[4-Chloro-3-(5-chloro-benzothiazo...) Show SMILES Clc1ccc2sc(nc2c1)-c1cc(NC(=O)CC#N)ccc1Cl Show InChI InChI=1S/C16H9Cl2N3OS/c17-9-1-4-14-13(7-9)21-16(23-14)11-8-10(2-3-12(11)18)20-15(22)5-6-19/h1-4,7-8H,5H2,(H,20,22)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141255 (CHEMBL35508 | [3-(5-Chloro-benzothiazol-2-yl)-4-me...) Show SMILES Cc1ccc(NC(=O)OCC#C)cc1-c1nc2cc(Cl)ccc2s1 Show InChI InChI=1S/C18H13ClN2O2S/c1-3-8-23-18(22)20-13-6-4-11(2)14(10-13)17-21-15-9-12(19)5-7-16(15)24-17/h1,4-7,9-10H,8H2,2H3,(H,20,22)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL 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
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141246 (CHEMBL35388 | [4-Chloro-3-(5-trifluoromethyl-benzo...) Show SMILES FC(F)(F)c1ccc2sc(nc2c1)-c1cc(NC(=O)OCC#C)ccc1Cl Show InChI InChI=1S/C18H10ClF3N2O2S/c1-2-7-26-17(25)23-11-4-5-13(19)12(9-11)16-24-14-8-10(18(20,21)22)3-6-15(14)27-16/h1,3-6,8-9H,7H2,(H,23,25)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144700 (6-(5-Bromo-2-ethoxy-phenyl)-N*4*-(4-chloro-phenyl)...) Show SMILES CCOc1ccc(Br)cc1-c1cc(Nc2ccc(Cl)cc2)nc(N)n1 Show InChI InChI=1S/C18H16BrClN4O/c1-2-25-16-8-3-11(19)9-14(16)15-10-17(24-18(21)23-15)22-13-6-4-12(20)5-7-13/h3-10H,2H2,1H3,(H3,21,22,23,24)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL 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
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144723 (4-[2-Amino-6-(5-bromo-2-ethoxy-phenyl)-pyrimidin-4...) Show SMILES CCOc1ccc(Br)cc1-c1cc(Nc2ccc(cc2)C#N)nc(N)n1 Show InChI InChI=1S/C19H16BrN5O/c1-2-26-17-8-5-13(20)9-15(17)16-10-18(25-19(22)24-16)23-14-6-3-12(11-21)4-7-14/h3-10H,2H2,1H3,(H3,22,23,24,25)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL 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
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144706 (6-(5-Chloro-2-ethoxy-phenyl)-N*4*-(4-chloro-phenyl...) Show SMILES CCOc1ccc(Cl)cc1-c1cc(Nc2ccc(Cl)cc2)nc(N)n1 Show InChI InChI=1S/C18H16Cl2N4O/c1-2-25-16-8-5-12(20)9-14(16)15-10-17(24-18(21)23-15)22-13-6-3-11(19)4-7-13/h3-10H,2H2,1H3,(H3,21,22,23,24)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144696 (6-(5-Bromo-2-methyl-phenyl)-N*4*-(4-bromo-phenyl)-...) Show SMILES Cc1ccc(Br)cc1-c1cc(Nc2ccc(Br)cc2)nc(N)n1 Show InChI InChI=1S/C17H14Br2N4/c1-10-2-3-12(19)8-14(10)15-9-16(23-17(20)22-15)21-13-6-4-11(18)5-7-13/h2-9H,1H3,(H3,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144694 (CHEMBL307716 | N*4*-(4-Chloro-phenyl)-6-(2,5-dichl...) Show SMILES Nc1nc(Nc2ccc(Cl)cc2)cc(n1)-c1cc(Cl)ccc1Cl Show InChI InChI=1S/C16H11Cl3N4/c17-9-1-4-11(5-2-9)21-15-8-14(22-16(20)23-15)12-7-10(18)3-6-13(12)19/h1-8H,(H3,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144714 (6-(5-Chloro-2-methyl-phenyl)-N*4*-(4-chloro-phenyl...) Show SMILES Cc1ccc(Cl)cc1-c1cc(Nc2ccc(Cl)cc2)nc(N)n1 Show InChI InChI=1S/C17H14Cl2N4/c1-10-2-3-12(19)8-14(10)15-9-16(23-17(20)22-15)21-13-6-4-11(18)5-7-13/h2-9H,1H3,(H3,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144702 (6-(5-Chloro-2-ethoxy-phenyl)-N*4*-(1H-indazol-6-yl...) Show SMILES CCOc1ccc(Cl)cc1-c1cc(Nc2ccc3c[nH]nc3c2)nc(N)n1 Show InChI InChI=1S/C19H17ClN6O/c1-2-27-17-6-4-12(20)7-14(17)16-9-18(25-19(21)24-16)23-13-5-3-11-10-22-26-15(11)8-13/h3-10H,2H2,1H3,(H,22,26)(H3,21,23,24,25)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141254 (CHEMBL422579 | N-[4-Chloro-3-(5-chloro-benzooxazol...) Show SMILES Clc1ccc2oc(nc2c1)-c1cc(NC(=O)CC#N)ccc1Cl Show InChI InChI=1S/C16H9Cl2N3O2/c17-9-1-4-14-13(7-9)21-16(23-14)11-8-10(2-3-12(11)18)20-15(22)5-6-19/h1-4,7-8H,5H2,(H,20,22)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144715 (2-{4-[2-Amino-6-(5-chloro-2-ethoxy-phenyl)-pyrimid...) Show SMILES CCOc1ccc(Cl)cc1-c1cc(Nc2ccc(CCO)cc2)nc(N)n1 Show InChI InChI=1S/C20H21ClN4O2/c1-2-27-18-8-5-14(21)11-16(18)17-12-19(25-20(22)24-17)23-15-6-3-13(4-7-15)9-10-26/h3-8,11-12,26H,2,9-10H2,1H3,(H3,22,23,24,25)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144725 (CHEMBL424605 | N*4*-(4-Bromo-phenyl)-6-(5-chloro-2...) Show SMILES COc1ccc(Cl)cc1-c1cc(Nc2ccc(Br)cc2)nc(N)n1 Show InChI InChI=1S/C17H14BrClN4O/c1-24-15-7-4-11(19)8-13(15)14-9-16(23-17(20)22-14)21-12-5-2-10(18)3-6-12/h2-9H,1H3,(H3,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144727 (6-(5-Bromo-2-methyl-phenyl)-N*4*-(4-chloro-phenyl)...) Show SMILES Cc1ccc(Br)cc1-c1cc(Nc2ccc(Cl)cc2)nc(N)n1 Show InChI InChI=1S/C17H14BrClN4/c1-10-2-3-11(18)8-14(10)15-9-16(23-17(20)22-15)21-13-6-4-12(19)5-7-13/h2-9H,1H3,(H3,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144698 (CHEMBL73376 | N*4*-(4-Bromo-phenyl)-6-(5-chloro-2-...) Show SMILES Cc1ccc(Cl)cc1-c1cc(Nc2ccc(Br)cc2)nc(N)n1 Show InChI InChI=1S/C17H14BrClN4/c1-10-2-5-12(19)8-14(10)15-9-16(23-17(20)22-15)21-13-6-3-11(18)4-7-13/h2-9H,1H3,(H3,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144709 (1-{4-[2-Amino-6-(5-bromo-2-ethoxy-phenyl)-pyrimidi...) Show SMILES CCOc1ccc(Br)cc1-c1cc(Nc2ccc(cc2)C(C)=O)nc(N)n1 Show InChI InChI=1S/C20H19BrN4O2/c1-3-27-18-9-6-14(21)10-16(18)17-11-19(25-20(22)24-17)23-15-7-4-13(5-8-15)12(2)26/h4-11H,3H2,1-2H3,(H3,22,23,24,25)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141279 (CHEMBL32894 | [4-Chloro-3-(5-chloro-benzooxazol-2-...) Show SMILES Clc1ccc2oc(nc2c1)-c1cc(NC(=O)OCC#C)ccc1Cl Show InChI InChI=1S/C17H10Cl2N2O3/c1-2-7-23-17(22)20-11-4-5-13(19)12(9-11)16-21-14-8-10(18)3-6-15(14)24-16/h1,3-6,8-9H,7H2,(H,20,22)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141269 (CHEMBL284111 | [4-Chloro-3-(5-chloro-benzothiazol-...) Show SMILES COC(=O)Nc1ccc(Cl)c(c1)-c1nc2cc(Cl)ccc2s1 Show InChI InChI=1S/C15H10Cl2N2O2S/c1-21-15(20)18-9-3-4-11(17)10(7-9)14-19-12-6-8(16)2-5-13(12)22-14/h2-7H,1H3,(H,18,20)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141251 ((3-Benzooxazol-2-yl-4-chloro-phenyl)-carbamic acid...) Show SMILES Clc1ccc(NC(=O)OCC#C)cc1-c1nc2ccccc2o1 Show InChI InChI=1S/C17H11ClN2O3/c1-2-9-22-17(21)19-11-7-8-13(18)12(10-11)16-20-14-5-3-4-6-15(14)23-16/h1,3-8,10H,9H2,(H,19,21)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141297 (CHEMBL35564 | N-[4-Chloro-3-(5-trifluoromethyl-ben...) Show SMILES FC(F)(F)c1ccc2sc(nc2c1)-c1cc(NC(=O)CC#N)ccc1Cl Show InChI InChI=1S/C17H9ClF3N3OS/c18-12-3-2-10(23-15(25)5-6-22)8-11(12)16-24-13-7-9(17(19,20)21)1-4-14(13)26-16/h1-4,7-8H,5H2,(H,23,25)	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
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144724 (6-(5-Chloro-2-methoxy-phenyl)-N*4*-(4-chloro-pheny...) Show SMILES COc1ccc(Cl)cc1-c1cc(Nc2ccc(Cl)cc2)nc(N)n1 Show InChI InChI=1S/C17H14Cl2N4O/c1-24-15-7-4-11(19)8-13(15)14-9-16(23-17(20)22-14)21-12-5-2-10(18)3-6-12/h2-9H,1H3,(H3,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	54	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141258 (CHEMBL418604 | [4-Chloro-3-(5-chloro-1-methyl-1H-b...) Show SMILES Cn1c(nc2cc(Cl)ccc12)-c1cc(NC(=O)OCC#C)ccc1Cl Show InChI InChI=1S/C18H13Cl2N3O2/c1-3-8-25-18(24)21-12-5-6-14(20)13(10-12)17-22-15-9-11(19)4-7-16(15)23(17)2/h1,4-7,9-10H,8H2,2H3,(H,21,24)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141287 (5TT4A4MBLR | CHEMBL36501 | CT 32228 | CT-32228 | H...) Show SMILES Cc1ccc(Cl)cc1-c1nc(N)nc(Nc2ccc(Br)cc2)n1 Show InChI InChI=1S/C16H13BrClN5/c1-9-2-5-11(18)8-13(9)14-21-15(19)23-16(22-14)20-12-6-3-10(17)4-7-12/h2-8H,1H3,(H3,19,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141296 (CHEMBL32731 | N-(3-Benzothiazol-2-yl-4-methyl-phen...) Show SMILES Cc1ccc(NC(=O)CC#N)cc1-c1nc2ccccc2s1 Show InChI InChI=1S/C17H13N3OS/c1-11-6-7-12(19-16(21)8-9-18)10-13(11)17-20-14-4-2-3-5-15(14)22-17/h2-7,10H,8H2,1H3,(H,19,21)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141283 (CHEMBL286639 | [4-Chloro-3-(5-chloro-benzooxazol-2...) Show SMILES CC#CCOC(=O)Nc1ccc(Cl)c(c1)-c1nc2cc(Cl)ccc2o1 Show InChI InChI=1S/C18H12Cl2N2O3/c1-2-3-8-24-18(23)21-12-5-6-14(20)13(10-12)17-22-15-9-11(19)4-7-16(15)25-17/h4-7,9-10H,8H2,1H3,(H,21,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144722 (CHEMBL75522 | {4-[2-Amino-6-(5-chloro-2-ethoxy-phe...) Show SMILES CCOc1ccc(Cl)cc1-c1cc(Nc2ccc(CO)cc2)nc(N)n1 Show InChI InChI=1S/C19H19ClN4O2/c1-2-26-17-8-5-13(20)9-15(17)16-10-18(24-19(21)23-16)22-14-6-3-12(11-25)4-7-14/h3-10,25H,2,11H2,1H3,(H3,21,22,23,24)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141291 (CHEMBL32553 | [4-Chloro-3-(5-chloro-benzooxazol-2-...) Show SMILES Clc1ccc2oc(nc2c1)-c1cc(NC(=O)OCCC#C)ccc1Cl Show InChI InChI=1S/C18H12Cl2N2O3/c1-2-3-8-24-18(23)21-12-5-6-14(20)13(10-12)17-22-15-9-11(19)4-7-16(15)25-17/h1,4-7,9-10H,3,8H2,(H,21,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144729 (6-(5-Chloro-2-methoxy-phenyl)-N*4*-(1H-indazol-6-y...) Show SMILES COc1ccc(Cl)cc1-c1cc(Nc2ccc3c[nH]nc3c2)nc(N)n1 Show InChI InChI=1S/C18H15ClN6O/c1-26-16-5-3-11(19)6-13(16)15-8-17(24-18(20)23-15)22-12-4-2-10-9-21-25-14(10)7-12/h2-9H,1H3,(H,21,25)(H3,20,22,23,24)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144711 (1-{4-[2-Amino-6-(5-bromo-2-ethoxy-phenyl)-pyrimidi...) Show SMILES CCOc1ccc(Br)cc1-c1cc(Nc2ccc(cc2)C(C)N=O)nc(N)n1 Show InChI InChI=1S/C20H20BrN5O2/c1-3-28-18-9-6-14(21)10-16(18)17-11-19(25-20(22)24-17)23-15-7-4-13(5-8-15)12(2)26-27/h4-12H,3H2,1-2H3,(H3,22,23,24,25)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	84	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144734 (4-[2-Amino-6-(5-bromo-2-ethoxy-phenyl)-pyrimidin-4...) Show SMILES CCOc1ccc(Br)cc1-c1cc(Nc2ccc(cc2)C(=O)NO)nc(N)n1 Show InChI InChI=1S/C19H18BrN5O3/c1-2-28-16-8-5-12(20)9-14(16)15-10-17(24-19(21)23-15)22-13-6-3-11(4-7-13)18(26)25-27/h3-10,27H,2H2,1H3,(H,25,26)(H3,21,22,23,24)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	88	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144719 (6-(5-Bromo-2-ethoxy-phenyl)-N*4*-(4-dihydroxyboron...) Show SMILES CCOc1ccc(Br)cc1-c1cc(Nc2ccc(cc2)B(O)O)nc(N)n1 Show InChI InChI=1S/C18H18BBrN4O3/c1-2-27-16-8-5-12(20)9-14(16)15-10-17(24-18(21)23-15)22-13-6-3-11(4-7-13)19(25)26/h3-10,25-26H,2H2,1H3,(H3,21,22,23,24)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	91	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50390673 (CHEMBL2070198) Show SMILES Brc1cccc(Nc2ncnc3ccc(NCc4ccc5OCCCOc5c4)cc23)c1 Show InChI InChI=1S/C24H21BrN4O2/c25-17-3-1-4-19(12-17)29-24-20-13-18(6-7-21(20)27-15-28-24)26-14-16-5-8-22-23(11-16)31-10-2-9-30-22/h1,3-8,11-13,15,26H,2,9-10,14H2,(H,27,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	98	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of EGFR in human A431 cell lysate using tyrosine/glutamic acid polymer as substrate by ELISA				Bioorg Med Chem Lett 22: 5870-5 (2012) Article DOI: 10.1016/j.bmcl.2012.07.079 BindingDB Entry DOI: 10.7270/Q26T0NRG
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141308 (CHEMBL418404 | Pent-4-ynoic acid [4-chloro-3-(5-ch...) Show SMILES Clc1ccc2oc(nc2c1)-c1cc(NC(=O)CCC#C)ccc1Cl Show InChI InChI=1S/C18H12Cl2N2O2/c1-2-3-4-17(23)21-12-6-7-14(20)13(10-12)18-22-15-9-11(19)5-8-16(15)24-18/h1,5-10H,3-4H2,(H,21,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141281 (CHEMBL35006 | N-[4-Chloro-3-(5-methyl-benzooxazol-...) Show SMILES Cc1ccc2oc(nc2c1)-c1cc(NC(=O)CC#N)ccc1Cl Show InChI InChI=1S/C17H12ClN3O2/c1-10-2-5-15-14(8-10)21-17(23-15)12-9-11(3-4-13(12)18)20-16(22)6-7-19/h2-5,8-9H,6H2,1H3,(H,20,22)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141272 (1-[4-Chloro-3-(5-chloro-benzooxazol-2-yl)-phenyl]-...) Show SMILES Clc1ccc2oc(nc2c1)-c1cc(NC(=O)NCC#C)ccc1Cl Show InChI InChI=1S/C17H11Cl2N3O2/c1-2-7-20-17(23)21-11-4-5-13(19)12(9-11)16-22-14-8-10(18)3-6-15(14)24-16/h1,3-6,8-9H,7H2,(H2,20,21,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM11639 (4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...) Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of COX-2 by chemiluminescent assay				Bioorg Med Chem 20: 6648-54 (2012) Article DOI: 10.1016/j.bmc.2012.09.021 BindingDB Entry DOI: 10.7270/Q2FX7BKC
					More data for this Ligand-Target Pair				3D Structure (crystal)
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141280 (CHEMBL33773 | [3-(5-Chloro-benzooxazol-2-yl)-4-met...) Show SMILES Cc1ccc(NC(=O)OCC#C)cc1-c1nc2cc(Cl)ccc2o1 Show InChI InChI=1S/C18H13ClN2O3/c1-3-8-23-18(22)20-13-6-4-11(2)14(10-13)17-21-15-9-12(19)5-7-16(15)24-17/h1,4-7,9-10H,8H2,2H3,(H,20,22)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141290 (CHEMBL34938 | [4-Chloro-3-(1-methyl-5-trifluoromet...) Show SMILES Cn1c(nc2cc(ccc12)C(F)(F)F)-c1cc(NC(=O)OCC#C)ccc1Cl Show InChI InChI=1S/C19H13ClF3N3O2/c1-3-8-28-18(27)24-12-5-6-14(20)13(10-12)17-25-15-9-11(19(21,22)23)4-7-16(15)26(17)2/h1,4-7,9-10H,8H2,2H3,(H,24,27)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144699 (6-(5-Bromo-2-ethoxy-phenyl)-N*4*-phenyl-pyrimidine...) Show SMILES CCOc1ccc(Br)cc1-c1cc(Nc2ccccc2)nc(N)n1 Show InChI InChI=1S/C18H17BrN4O/c1-2-24-16-9-8-12(19)10-14(16)15-11-17(23-18(20)22-15)21-13-6-4-3-5-7-13/h3-11H,2H2,1H3,(H3,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
Aurora kinase A (Homo sapiens (Human))	BDBM13534 (CHEMBL572878 | N-[4-({4-[(3-methyl-1H-pyrazol-5-yl...) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H28N8OS/c1-15-13-20(29-28-15)25-19-14-21(31-11-9-30(2)10-12-31)27-23(26-19)33-18-7-5-17(6-8-18)24-22(32)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,32)(H2,25,26,27,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of human recombinant Aurora A kinase using biotinylated peptide substrate preincubated for 15 mins with compound measured after 30 mins by...				Bioorg Med Chem Lett 22: 3589-93 (2012) Article DOI: 10.1016/j.bmcl.2012.04.066 BindingDB Entry DOI: 10.7270/Q2GF0VJZ
					More data for this Ligand-Target Pair				3D Structure (crystal)
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141284 (CHEMBL35051 | [4-Chloro-3-(5-trifluoromethyl-benzo...) Show SMILES FC(F)(F)c1ccc2oc(nc2c1)-c1cc(NC(=O)OCC#C)ccc1Cl Show InChI InChI=1S/C18H10ClF3N2O3/c1-2-7-26-17(25)23-11-4-5-13(19)12(9-11)16-24-14-8-10(18(20,21)22)3-6-15(14)27-16/h1,3-6,8-9H,7H2,(H,23,25)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144701 (6-(5-Chloro-2-methyl-phenyl)-N*4*-(4-trifluorometh...) Show SMILES Cc1ccc(Cl)cc1-c1cc(Nc2ccc(cc2)C(F)(F)F)nc(N)n1 Show InChI InChI=1S/C18H14ClF3N4/c1-10-2-5-12(19)8-14(10)15-9-16(26-17(23)25-15)24-13-6-3-11(4-7-13)18(20,21)22/h2-9H,1H3,(H3,23,24,25,26)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50144733 (CHEMBL73947 | N*4*-(4-Chloro-phenyl)-6-(5-fluoro-2...) Show SMILES Cc1ccc(F)cc1-c1cc(Nc2ccc(Cl)cc2)nc(N)n1 Show InChI InChI=1S/C17H14ClFN4/c1-10-2-5-12(19)8-14(10)15-9-16(23-17(20)22-15)21-13-6-3-11(18)4-7-13/h2-9H,1H3,(H3,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Lysophosphatidic acid acyltransferase-beta expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 2303-8 (2004) Article DOI: 10.1016/j.bmcl.2004.01.104 BindingDB Entry DOI: 10.7270/Q2Q23ZPH
					More data for this Ligand-Target Pair
Aurora kinase A (Homo sapiens (Human))	BDBM50383835 (CHEMBL2030993) Show SMILES CCOc1ccc(NC(=O)c2cn(nc2-c2ccc(cc2)[N+]([O-])=O)-c2ccccc2)cc1 Show InChI InChI=1S/C24H20N4O4/c1-2-32-21-14-10-18(11-15-21)25-24(29)22-16-27(19-6-4-3-5-7-19)26-23(22)17-8-12-20(13-9-17)28(30)31/h3-16H,2H2,1H3,(H,25,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of human recombinant Aurora A kinase using biotinylated peptide substrate preincubated for 15 mins with compound measured after 30 mins by...				Bioorg Med Chem Lett 22: 3589-93 (2012) Article DOI: 10.1016/j.bmcl.2012.04.066 BindingDB Entry DOI: 10.7270/Q2GF0VJZ
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141257 (CHEMBL286925 | [4-Chloro-3-(4-methyl-benzooxazol-2...) Show SMILES Cc1cccc2oc(nc12)-c1cc(NC(=O)OCC#C)ccc1Cl Show InChI InChI=1S/C18H13ClN2O3/c1-3-9-23-18(22)20-12-7-8-14(19)13(10-12)17-21-16-11(2)5-4-6-15(16)24-17/h1,4-8,10H,9H2,2H3,(H,20,22)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141282 (2-Azido-N-[4-chloro-3-(5-chloro-benzooxazol-2-yl)-...) Show SMILES Clc1ccc2oc(nc2c1)-c1cc(NC(=O)CN=[N+]=[N-])ccc1Cl Show InChI InChI=1S/C15H9Cl2N5O2/c16-8-1-4-13-12(5-8)21-15(24-13)10-6-9(2-3-11(10)17)20-14(23)7-19-22-18/h1-6H,7H2,(H,20,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta (Homo sapiens (Human))	BDBM50141271 (CHEMBL34585 | [4-Chloro-3-(5-methyl-benzooxazol-2-...) Show SMILES Cc1ccc2oc(nc2c1)-c1cc(NC(=O)OCC#C)ccc1Cl Show InChI InChI=1S/C18H13ClN2O3/c1-3-8-23-18(22)20-12-5-6-14(19)13(10-12)17-21-15-9-11(2)4-7-16(15)24-17/h1,4-7,9-10H,8H2,2H3,(H,20,22)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Cell Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory concentration against human lysophosphatidic acid acyltransferase-beta (LPAAT-beta) expressed in Sf9 insect cell membranes				Bioorg Med Chem Lett 14: 1455-9 (2004) Article DOI: 10.1016/j.bmcl.2004.01.023 BindingDB Entry DOI: 10.7270/Q20Z72Q5
					More data for this Ligand-Target Pair

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