Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 718.3 BDBM50292817

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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
Cytosolic phospholipase A2 (Homo sapiens (Human))	BDBM50292817 (4-(2-{1-Benzhydryl-5-chloro-2-[2-({[2-(4-thiomorph...) Show SMILES OC(=O)c1ccc(OCCc2c(CCNS(=O)(=O)CCN3CCSCC3)n(C(c3ccccc3)c3ccccc3)c3ccc(Cl)cc23)cc1 Show InChI InChI=1S/C38H40ClN3O5S2/c39-31-13-16-35-34(27-31)33(18-23-47-32-14-11-30(12-15-32)38(43)44)36(17-19-40-49(45,46)26-22-41-20-24-48-25-21-41)42(35)37(28-7-3-1-4-8-28)29-9-5-2-6-10-29/h1-16,27,37,40H,17-26H2,(H,43,44)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of human cytosolic PLA2alpha by GLU micelle assay				J Med Chem 52: 1156-71 (2009) Article DOI: 10.1021/jm8009876 BindingDB Entry DOI: 10.7270/Q20C4VSK
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