Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50334588'   

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))	BDBM50334588 ((R,S)-N3-(1-(1-Adamantyl)ethyl)-1,6-diphenyl-4-oxo...) Show SMILES CC(NC(=O)c1cn(-c2ccccc2)c(cc1=O)-c1ccccc1)C12CC3CC(CC(C3)C1)C2 |TLB:1:24:27.26.31:29,THB:25:26:29:33.24.32,25:24:27.26.31:29,1:24:27:31.30.29,32:24:27:31.30.29,32:30:27:33.25.24| Show InChI InChI=1S/C30H32N2O2/c1-20(30-16-21-12-22(17-30)14-23(13-21)18-30)31-29(34)26-19-32(25-10-6-3-7-11-25)27(15-28(26)33)24-8-4-2-5-9-24/h2-11,15,19-23H,12-14,16-18H2,1H3,(H,31,34)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universite£? Lille-Nord de France Curated by ChEMBL					Assay Description Displacement of [3H]-SR141716A from human CB1 receptor expressed in CHO cells after 1 hr				J Med Chem 53: 7918-31 (2010) Article DOI: 10.1021/jm100286k BindingDB Entry DOI: 10.7270/Q2BR8SFP
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