Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50389936'   

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))	BDBM50389936 (CHEMBL2071072) Show SMILES [O-][N+](=O)c1ccc(CCNC(=O)c2cc3cc(Cl)ccc3[nH]2)cc1 Show InChI InChI=1S/C17H14ClN3O3/c18-13-3-6-15-12(9-13)10-16(20-15)17(22)19-8-7-11-1-4-14(5-2-11)21(23)24/h1-6,9-10,20H,7-8H2,(H,19,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Allosteric modulation of human recombinant CB1 receptor expressed in HEK293 cells assessed as stimulation of [3H]CP55940 binding				J Med Chem 55: 5627-31 (2012) Article DOI: 10.1021/jm201485c BindingDB Entry DOI: 10.7270/Q27W6D8K
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