Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 714.3 BDBM50292819

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))	BDBM50292819 (4-(2-{1-Benzhydryl-5-chloro-2-[2-({[2-(4-methylpip...) Show SMILES CC1CCN(CCS(=O)(=O)NCCc2c(CCOc3ccc(cc3)C(O)=O)c3cc(Cl)ccc3n2C(c2ccccc2)c2ccccc2)CC1 Show InChI InChI=1S/C40H44ClN3O5S/c1-29-19-23-43(24-20-29)25-27-50(47,48)42-22-18-38-35(21-26-49-34-15-12-32(13-16-34)40(45)46)36-28-33(41)14-17-37(36)44(38)39(30-8-4-2-5-9-30)31-10-6-3-7-11-31/h2-17,28-29,39,42H,18-27H2,1H3,(H,45,46)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	220	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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