Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50039495'   

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))	BDBM50039495 (CHEMBL3357339) Show SMILES C[C@H](CO)n1c(nc2c(nc(C)nc12)N1CCN(C)CC1)-c1ccccc1Cl |r| Show InChI InChI=1S/C20H25ClN6O/c1-13(12-28)27-18(15-6-4-5-7-16(15)21)24-17-19(22-14(2)23-20(17)27)26-10-8-25(3)9-11-26/h4-7,13,28H,8-12H2,1-3H3/t13-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Agonist activity at human CB1 receptor expressed in Sf9 cells by [35S]-GTPgammaS binding assay				Bioorg Med Chem Lett 24: 5572-5 (2014) Article DOI: 10.1016/j.bmcl.2014.11.006 BindingDB Entry DOI: 10.7270/Q2R78GVW
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