Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50342049'   

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))	BDBM50342049 (CHEMBL1765681 | N-(4-Cyanotetrahydro-2H-pyran-4-yl...) Show SMILES Cc1c(nn(c1-c1ccccc1)-c1ccccc1-c1ccccc1)C(=O)NC1(CCOCC1)C#N Show InChI InChI=1S/C29H26N4O2/c1-21-26(28(34)31-29(20-30)16-18-35-19-17-29)32-33(27(21)23-12-6-3-7-13-23)25-15-9-8-14-24(25)22-10-4-2-5-11-22/h2-15H,16-19H2,1H3,(H,31,34)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Mental Health Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from CB1 receptor				J Med Chem 54: 2961-70 (2011) Article DOI: 10.1021/jm2000536 BindingDB Entry DOI: 10.7270/Q2KS6SJS
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