Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50341962'   

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))	BDBM50341962 (CHEMBL1765288 | cis-rac-((4S,4aR,8aS)-4-hydroxy-4-...) Show SMILES O[C@]1(CCN([C@H]2CCCC[C@@H]12)C(=O)C1CN(CC(F)(F)F)CCO1)c1ccccc1 |r| Show InChI InChI=1S/C22H29F3N2O3/c23-22(24,25)15-26-12-13-30-19(14-26)20(28)27-11-10-21(29,16-6-2-1-3-7-16)17-8-4-5-9-18(17)27/h1-3,6-7,17-19,29H,4-5,8-15H2/t17-,18+,19?,21-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity at human CB1 receptor expressed in CHOK1 cells assessed as inhibition of forskolin-induced cAMP production treated 15 mins before fo...				Bioorg Med Chem Lett 21: 2359-64 (2011) Article DOI: 10.1016/j.bmcl.2011.02.078 BindingDB Entry DOI: 10.7270/Q2M90901
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