Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50287802'   

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))	BDBM50287802 ((4-Chloro-phenyl)-[5-methoxy-2-methyl-3-(2-morphol...) Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CCN3CCOCC3)c2c1 Show InChI InChI=1S/C23H25ClN2O3/c1-16-20(9-10-25-11-13-29-14-12-25)21-15-19(28-2)7-8-22(21)26(16)23(27)17-3-5-18(24)6-4-17/h3-8,15H,9-14H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	1.03E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Evaluated for binding affinity against recombinant human central cannabinoid receptor 1				Bioorg Med Chem Lett 6: 2263-2268 (1996) Article DOI: 10.1016/0960-894X(96)00426-X BindingDB Entry DOI: 10.7270/Q2MS3SRN
					More data for this Ligand-Target Pair