BDBM50136732 4-(1-Benzhydryl-5-methanesulfonyl-1H-indol-3-ylmethyl)-3-methoxy-benzoic acid::CHEMBL138867

SMILES: COc1cc(ccc1Cc1cn(C(c2ccccc2)c2ccccc2)c2ccc(cc12)S(C)(=O)=O)C(O)=O

InChI Key: InChIKey=GBAOAWUBZJDJCA-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50136732   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
cPLA2 C2 (Homo sapiens (Human))	BDBM50136732 (4-(1-Benzhydryl-5-methanesulfonyl-1H-indol-3-ylmet...) Show SMILES COc1cc(ccc1Cc1cn(C(c2ccccc2)c2ccccc2)c2ccc(cc12)S(C)(=O)=O)C(O)=O Show InChI InChI=1S/C31H27NO5S/c1-37-29-18-24(31(33)34)14-13-23(29)17-25-20-32(28-16-15-26(19-27(25)28)38(2,35)36)30(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-16,18-20,30H,17H2,1-2H3,(H,33,34)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description In vitro inhibition of cystolic phospholipase A2 alpha.				Bioorg Med Chem Lett 13: 4501-4 (2003) BindingDB Entry DOI: 10.7270/Q2W095BN
					More data for this Ligand-Target Pair