BDBM50125732 1-(3,5-Dichloro-phenyl)-3-{3-[3-(3,5-dichloro-phenyl)-ureido]-phenyl}-urea::CHEMBL13342

SMILES: Clc1cc(Cl)cc(NC(=O)Nc2cccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)c2)c1

InChI Key: InChIKey=VUHXOKNJUOHCOQ-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 = 50125732   

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)	BDBM50125732 (1-(3,5-Dichloro-phenyl)-3-{3-[3-(3,5-dichloro-phen...) Show SMILES Clc1cc(Cl)cc(NC(=O)Nc2cccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)c2)c1 Show InChI InChI=1S/C20H14Cl4N4O2/c21-11-4-12(22)7-17(6-11)27-19(29)25-15-2-1-3-16(10-15)26-20(30)28-18-8-13(23)5-14(24)9-18/h1-10H,(H2,25,27,29)(H2,26,28,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.95E+3	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