Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50247430'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50247430 (1-(2,4-Dichlorophenyl)-5-(4-iodophenyl)-N-piperidi...) Show SMILES Clc1ccc(c(Cl)c1)-n1ncc(C(=O)NN2CCCCC2)c1-c1ccc(I)cc1 Show InChI InChI=1S/C21H19Cl2IN4O/c22-15-6-9-19(18(23)12-15)28-20(14-4-7-16(24)8-5-14)17(13-25-28)21(29)26-27-10-2-1-3-11-27/h4-9,12-13H,1-3,10-11H2,(H,26,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Genova Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells				Eur J Med Chem 43: 2627-38 (2008) Article DOI: 10.1016/j.ejmech.2008.01.043 BindingDB Entry DOI: 10.7270/Q2ZS2W9S
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