Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50317253'   

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))	BDBM50317253 (1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-5-iodo-N...) Show SMILES Clc1ccc(cc1)-n1c(I)c(nc1-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1 Show InChI InChI=1S/C21H18Cl3IN4O/c22-13-4-7-15(8-5-13)29-19(25)18(21(30)27-28-10-2-1-3-11-28)26-20(29)16-9-6-14(23)12-17(16)24/h4-9,12H,1-3,10-11H2,(H,27,30)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Solvay Pharma Curated by ChEMBL					Assay Description Displacement of [3H]CP-55940 from human CB1 receptor expressed in CHO cells				Bioorg Med Chem Lett 20: 2770-5 (2010) Article DOI: 10.1016/j.bmcl.2010.03.068 BindingDB Entry DOI: 10.7270/Q2XG9S33
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