Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phospholipase A2, major isoenzyme' and Ligand = 'BDBM50206915'   

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))	BDBM50206915 ((+/-)-1-O-ethyl-3-O-[4-(4,5-dihydro-5-oxo-1,2,4-4H...) Show SMILES CCCCCCCCCCCCCCOC(COCC)COc1ccc(cc1)-c1nc(=O)o[nH]1 Show InChI InChI=1S/C27H44N2O5/c1-3-5-6-7-8-9-10-11-12-13-14-15-20-32-25(21-31-4-2)22-33-24-18-16-23(17-19-24)26-28-27(30)34-29-26/h16-19,25H,3-15,20-22H2,1-2H3,(H,28,29,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris7-Denis Diderot Curated by ChEMBL					Assay Description Inhibition of pig group IB PLA2 by fluorimetric assay				J Med Chem 50: 1618-26 (2007) Article DOI: 10.1021/jm060082n BindingDB Entry DOI: 10.7270/Q2TQ6174
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