Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50208965'   

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))	BDBM50208965 (CHEMBL389198 | rac-1-(4-chlorophenyl)-2-(2,4-dichl...) Show SMILES OC1CCCCC1NC(=O)c1cn(c(n1)-c1ccc(Cl)cc1Cl)-c1ccc(Cl)cc1 |w:6.7,1.0| Show InChI InChI=1S/C22H20Cl3N3O2/c23-13-5-8-15(9-6-13)28-12-19(22(30)27-18-3-1-2-4-20(18)29)26-21(28)16-10-7-14(24)11-17(16)25/h5-12,18,20,29H,1-4H2,(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	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bayer HealthCare Curated by ChEMBL					Assay Description Displacement of [3H]CP559440 from human CB1 receptor expressed in HEK293 cells				Bioorg Med Chem Lett 17: 2706-11 (2007) Article DOI: 10.1016/j.bmcl.2007.03.011 BindingDB Entry DOI: 10.7270/Q2H70FGB
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