BDBM50140227 1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-ethynyl-1H-imidazole-4-carboxylic acid (hexahydro-cyclopenta[c]pyrrol-2-yl)-amide::CHEMBL418544

SMILES: Clc1ccc(cc1)-n1c(nc(C(=O)NN2CC3CCCC3C2)c1C#C)-c1ccc(Cl)cc1Cl

InChI Key: InChIKey=ULRUFKHACATFKA-UHFFFAOYSA-N

Data: 1 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50140227   

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
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50140227 (1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-ethy...) Show SMILES Clc1ccc(cc1)-n1c(nc(C(=O)NN2CC3CCCC3C2)c1C#C)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C25H21Cl3N4O/c1-2-22-23(25(33)30-31-13-15-4-3-5-16(15)14-31)29-24(20-11-8-18(27)12-21(20)28)32(22)19-9-6-17(26)7-10-19/h1,6-12,15-16H,3-5,13-14H2,(H,30,33)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	770	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences Inc. Curated by ChEMBL					Assay Description Evaluated for binding affinity towards human Cannabinoid receptor 1				Bioorg Med Chem Lett 14: 1151-4 (2004) Article DOI: 10.1016/j.bmcl.2003.12.068 BindingDB Entry DOI: 10.7270/Q2MW2GKB
					More data for this Ligand-Target Pair