Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50222801'   

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))	BDBM50222801 ((2-cyclopentyl-4-methyl-1,2,3,4-tetrahydropyrrolo[...) Show SMILES CC1CCN(CC1)C(=O)c1ccc2n(C)c3CN(Cc3c2c1)C1CCCC1 Show InChI InChI=1S/C23H31N3O/c1-16-9-11-25(12-10-16)23(27)17-7-8-21-19(13-17)20-14-26(15-22(20)24(21)2)18-5-3-4-6-18/h7-8,13,16,18H,3-6,9-12,14-15H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.81E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Montreal Curated by ChEMBL					Assay Description Binding affinity to human CB1 receptor				Bioorg Med Chem Lett 17: 6183-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.019 BindingDB Entry DOI: 10.7270/Q2TH8MD3
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