Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50380853'   

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))	BDBM50380853 (CHEMBL2018657) Show SMILES CN(CCO)C(=O)C(C)(C)NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O Show InChI InChI=1S/C26H41N3O4/c1-26(2,25(33)28(3)15-16-30)27-23(31)21-17-20-13-9-4-5-10-14-22(20)29(24(21)32)18-19-11-7-6-8-12-19/h17,19,30H,4-16,18H2,1-3H3,(H,27,31)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi& Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis				Bioorg Med Chem Lett 22: 2894-7 (2012) Article DOI: 10.1016/j.bmcl.2012.02.054 BindingDB Entry DOI: 10.7270/Q2NV9K85
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