Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50213471'   

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))	BDBM50213471 ((S)-N-(1-amino-4-methyl-1-oxopentan-2-yl)-5,6-dip-...) Show SMILES CC(C)C[C@H](NC(=O)c1cnc(-c2ccc(C)cc2)c(n1)-c1ccc(C)cc1)C(N)=O Show InChI InChI=1S/C25H28N4O2/c1-15(2)13-20(24(26)30)29-25(31)21-14-27-22(18-9-5-16(3)6-10-18)23(28-21)19-11-7-17(4)8-12-19/h5-12,14-15,20H,13H2,1-4H3,(H2,26,30)(H,29,31)/t20-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	105	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity to human CB1 receptor				Bioorg Med Chem Lett 17: 3978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.04.087 BindingDB Entry DOI: 10.7270/Q2FN15XR
					More data for this Ligand-Target Pair