BDBM50125731 3,5-Dichloro-N-[3-(3,3-diphenyl-propionylamino)-phenyl]-benzamide::CHEMBL13602

SMILES: Clc1cc(Cl)cc(c1)C(=O)Nc1cccc(NC(=O)CC(c2ccccc2)c2ccccc2)c1

InChI Key: InChIKey=HUXQGPRFJHZTRO-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 = 50125731   

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
Cyclophilin A (Rattus norvegicus)	BDBM50125731 (3,5-Dichloro-N-[3-(3,3-diphenyl-propionylamino)-ph...) Show SMILES Clc1cc(Cl)cc(c1)C(=O)Nc1cccc(NC(=O)CC(c2ccccc2)c2ccccc2)c1 Show InChI InChI=1S/C28H22Cl2N2O2/c29-22-14-21(15-23(30)16-22)28(34)32-25-13-7-12-24(17-25)31-27(33)18-26(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-17,26H,18H2,(H,31,33)(H,32,34)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	870	n/a	n/a	n/a	n/a	n/a	n/a
Guilford Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description In vitro inhibition of the rotamase activity of cyclophilin A (CyPA)				J Med Chem 46: 1112-5 (2003) Article DOI: 10.1021/jm020409u BindingDB Entry DOI: 10.7270/Q2V1244X
					More data for this Ligand-Target Pair