Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Phospholipase A2, membrane associated' and Ligand = 'BDBM50055426'   

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
Phospholipase A2, membrane associated (Rattus norvegicus)	BDBM50055426 (Bis[3-[[4-[(4-carboxy-3-methoxy-2,5,6-trimethylphe...) Show SMILES COc1ccc(cc1C(=O)Oc1c(C)c(C)c(C(=O)Oc2c(C)c(C)c(C(O)=O)c(OC)c2C)c(OC)c1C)S(=O)c1ccc(OC)c(c1)C(=O)Oc1c(C)c(C)c(C(=O)Oc2c(C)c(C)c(C(O)=O)c(OC)c2C)c(OC)c1C Show InChI InChI=1S/C60H62O19S/c1-25-29(5)49(33(9)51(72-15)43(25)55(61)62)78-59(67)45-27(3)31(7)47(35(11)53(45)74-17)76-57(65)39-23-37(19-21-41(39)70-13)80(69)38-20-22-42(71-14)40(24-38)58(66)77-48-32(8)28(4)46(54(75-18)36(48)12)60(68)79-50-30(6)26(2)44(56(63)64)52(73-16)34(50)10/h19-24H,1-18H3,(H,61,62)(H,63,64)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi& Co., Ltd. Curated by ChEMBL					Assay Description In vitro inhibition of rat secretory Phospholipase A2 (group II).				J Med Chem 39: 5183-91 (1997) Article DOI: 10.1021/jm960437a BindingDB Entry DOI: 10.7270/Q2K64JQH
					More data for this Ligand-Target Pair
Phospholipase A2, membrane associated (Homo sapiens (Human))	BDBM50055426 (Bis[3-[[4-[(4-carboxy-3-methoxy-2,5,6-trimethylphe...) Show SMILES COc1ccc(cc1C(=O)Oc1c(C)c(C)c(C(=O)Oc2c(C)c(C)c(C(O)=O)c(OC)c2C)c(OC)c1C)S(=O)c1ccc(OC)c(c1)C(=O)Oc1c(C)c(C)c(C(=O)Oc2c(C)c(C)c(C(O)=O)c(OC)c2C)c(OC)c1C Show InChI InChI=1S/C60H62O19S/c1-25-29(5)49(33(9)51(72-15)43(25)55(61)62)78-59(67)45-27(3)31(7)47(35(11)53(45)74-17)76-57(65)39-23-37(19-21-41(39)70-13)80(69)38-20-22-42(71-14)40(24-38)58(66)77-48-32(8)28(4)46(54(75-18)36(48)12)60(68)79-50-30(6)26(2)44(56(63)64)52(73-16)34(50)10/h19-24H,1-18H3,(H,61,62)(H,63,64)	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	2.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi& Co., Ltd. Curated by ChEMBL					Assay Description In vitro inhibition of human recombinant secretory Phospholipase A2 (group II).				J Med Chem 39: 5183-91 (1997) Article DOI: 10.1021/jm960437a BindingDB Entry DOI: 10.7270/Q2K64JQH
					More data for this Ligand-Target Pair