Compile Data Set for Download or QSAR

Found 8 hits Enz. Inhib. hit(s) with Target = 'Phospholipase A2 isozyme PLA-A'   

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
Basic phospholipase A2 PLA-A (Trimeresurus flavoviridis)	BDBM50169761 (2-(3-chlorobenzoyl)-4-methylphenyl 3-chlorobenzoat...) Show SMILES Cc1ccc(OC(=O)c2cccc(Cl)c2)c(c1)C(=O)c1cccc(Cl)c1 Show InChI InChI=1S/C21H14Cl2O3/c1-13-8-9-19(26-21(25)15-5-3-7-17(23)12-15)18(10-13)20(24)14-4-2-6-16(22)11-14/h2-12H,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description In vitro inhibitory concentration against phospholipase A2 of Trimeresurus flavoviridis venom				Bioorg Med Chem Lett 15: 4100-4 (2005) Article DOI: 10.1016/j.bmcl.2005.06.012 BindingDB Entry DOI: 10.7270/Q25B021W
					More data for this Ligand-Target Pair
Basic phospholipase A2 PLA-A (Trimeresurus flavoviridis)	BDBM50148911 ((3beta)-3-hydroxyurs-12-en-28-oic acid | 3beta-hyd...) Show SMILES C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O |r,c:9| Show InChI InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description In vitro inhibitory concentration against phospholipase A2 of Trimeresurus flavoviridis venom				Bioorg Med Chem Lett 15: 4100-4 (2005) Article DOI: 10.1016/j.bmcl.2005.06.012 BindingDB Entry DOI: 10.7270/Q25B021W
					More data for this Ligand-Target Pair
Basic phospholipase A2 PLA-A (Trimeresurus flavoviridis)	BDBM50169755 (4-chloro-2-(2,3-dichlorobenzoyl)phenyl benzoate | ...) Show SMILES Clc1ccc(OC(=O)c2ccccc2)c(c1)C(=O)c1cccc(Cl)c1Cl Show InChI InChI=1S/C20H11Cl3O3/c21-13-9-10-17(26-20(25)12-5-2-1-3-6-12)15(11-13)19(24)14-7-4-8-16(22)18(14)23/h1-11H	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description In vitro inhibitory concentration against phospholipase A2 of Trimeresurus flavoviridis venom				Bioorg Med Chem Lett 15: 4100-4 (2005) Article DOI: 10.1016/j.bmcl.2005.06.012 BindingDB Entry DOI: 10.7270/Q25B021W
					More data for this Ligand-Target Pair
Basic phospholipase A2 PLA-A (Trimeresurus flavoviridis)	BDBM50169758 (2-benzoyl-4-methylphenyl benzoate | Benzoic acid 2...) Show SMILES Cc1ccc(OC(=O)c2ccccc2)c(c1)C(=O)c1ccccc1 Show InChI InChI=1S/C21H16O3/c1-15-12-13-19(24-21(23)17-10-6-3-7-11-17)18(14-15)20(22)16-8-4-2-5-9-16/h2-14H,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description In vitro inhibitory concentration against phospholipase A2 of Trimeresurus flavoviridis venom				Bioorg Med Chem Lett 15: 4100-4 (2005) Article DOI: 10.1016/j.bmcl.2005.06.012 BindingDB Entry DOI: 10.7270/Q25B021W
					More data for this Ligand-Target Pair
Basic phospholipase A2 PLA-A (Trimeresurus flavoviridis)	BDBM50169757 (Benzoic acid 4-(2-methyl-benzoyl)-phenyl ester | C...) Show SMILES Cc1ccc(cc1)C(=O)Oc1ccc(cc1C)C(=O)c1ccccc1C Show InChI InChI=1S/C23H20O3/c1-15-8-10-18(11-9-15)23(25)26-21-13-12-19(14-17(21)3)22(24)20-7-5-4-6-16(20)2/h4-14H,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description In vitro inhibitory concentration against phospholipase A2 of Trimeresurus flavoviridis venom				Bioorg Med Chem Lett 15: 4100-4 (2005) Article DOI: 10.1016/j.bmcl.2005.06.012 BindingDB Entry DOI: 10.7270/Q25B021W
					More data for this Ligand-Target Pair
Basic phospholipase A2 PLA-A (Trimeresurus flavoviridis)	BDBM50169760 (Benzoic acid 4-(2,3-dichloro-benzoyl)-2-methyl-phe...) Show SMILES Cc1cc(ccc1OC(=O)c1ccccc1)C(=O)c1cccc(Cl)c1Cl Show InChI InChI=1S/C21H14Cl2O3/c1-13-12-15(20(24)16-8-5-9-17(22)19(16)23)10-11-18(13)26-21(25)14-6-3-2-4-7-14/h2-12H,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description In vitro inhibitory concentration against phospholipase A2 of Trimeresurus flavoviridis venom				Bioorg Med Chem Lett 15: 4100-4 (2005) Article DOI: 10.1016/j.bmcl.2005.06.012 BindingDB Entry DOI: 10.7270/Q25B021W
					More data for this Ligand-Target Pair
Basic phospholipase A2 PLA-A (Trimeresurus flavoviridis)	BDBM50169756 (4-Methyl-benzoic acid 4-methyl-2-(4-methyl-benzoyl...) Show SMILES Cc1ccc(cc1)C(=O)Oc1ccc(C)cc1C(=O)c1ccc(C)cc1 Show InChI InChI=1S/C23H20O3/c1-15-4-9-18(10-5-15)22(24)20-14-17(3)8-13-21(20)26-23(25)19-11-6-16(2)7-12-19/h4-14H,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.08E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description In vitro inhibitory concentration against phospholipase A2 of Trimeresurus flavoviridis venom				Bioorg Med Chem Lett 15: 4100-4 (2005) Article DOI: 10.1016/j.bmcl.2005.06.012 BindingDB Entry DOI: 10.7270/Q25B021W
					More data for this Ligand-Target Pair
Basic phospholipase A2 PLA-A (Trimeresurus flavoviridis)	BDBM50169759 (2-Methyl-benzoic acid 4-methyl-2-(2-methyl-benzoyl...) Show SMILES Cc1ccc(OC(=O)c2ccccc2C)c(c1)C(=O)c1ccccc1C Show InChI InChI=1S/C23H20O3/c1-15-12-13-21(26-23(25)19-11-7-5-9-17(19)3)20(14-15)22(24)18-10-6-4-8-16(18)2/h4-14H,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.39E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description In vitro inhibitory concentration against phospholipase A2 of Trimeresurus flavoviridis venom				Bioorg Med Chem Lett 15: 4100-4 (2005) Article DOI: 10.1016/j.bmcl.2005.06.012 BindingDB Entry DOI: 10.7270/Q25B021W
					More data for this Ligand-Target Pair