Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phospholipase A2, major isoenzyme' and Ligand = 'BDBM50316459'   

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, major isoenzyme (Sus scrofa (pig))	BDBM50316459 (1-[4-(4,5-Dihydro-1,2,4-(4H)-5-oxo-oxadiazol-3-ylm...) Show SMILES CCCCCCCCCCCCCCOc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc(Cc2nc(=O)o[nH]2)cc1 Show InChI InChI=1S/C34H48N4O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-26-41-31-20-18-30(19-21-31)37-22-24-38(25-23-37)33(39)29-16-14-28(15-17-29)27-32-35-34(40)42-36-32/h14-21H,2-13,22-27H2,1H3,(H,35,36,40)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.33E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Diderot Curated by ChEMBL					Assay Description Inhibition of porcine group 1B phospholipase A2 by fluorimetric assay				Bioorg Med Chem 18: 3588-600 (2010) Article DOI: 10.1016/j.bmc.2010.03.049 BindingDB Entry DOI: 10.7270/Q2ZG6SD9
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