BDBM50292834 4-[2-(1-Benzhydryl-5-chloro-2-{2-[({[(3,4-dichlorophenyl)thio]methyl}sulfonyl)amino]ethyl}-1H-indol-3-yl)ethoxy]benzoic Acid::CHEMBL449829

SMILES: OC(=O)c1ccc(OCCc2c(CCNS(=O)(=O)CSc3ccc(Cl)c(Cl)c3)n(C(c3ccccc3)c3ccccc3)c3ccc(Cl)cc23)cc1

InChI Key: InChIKey=LZQCZPJJUJCHCV-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 = 50292834   

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))	BDBM50292834 (4-[2-(1-Benzhydryl-5-chloro-2-{2-[({[(3,4-dichloro...) Show SMILES OC(=O)c1ccc(OCCc2c(CCNS(=O)(=O)CSc3ccc(Cl)c(Cl)c3)n(C(c3ccccc3)c3ccccc3)c3ccc(Cl)cc23)cc1 Show InChI InChI=1S/C39H33Cl3N2O5S2/c40-29-13-18-36-33(23-29)32(20-22-49-30-14-11-28(12-15-30)39(45)46)37(19-21-43-51(47,48)25-50-31-16-17-34(41)35(42)24-31)44(36)38(26-7-3-1-4-8-26)27-9-5-2-6-10-27/h1-18,23-24,38,43H,19-22,25H2,(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	240	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
					More data for this Ligand-Target Pair