Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM93457'   

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))	BDBM93457 (hCB1 Inhibitor, 2{6,1,7}) Show SMILES CCCCNC(=O)c1cnn(c1-c1ccc(cc1)-c1ccccc1)-c1cccc(C)c1 Show InChI InChI=1S/C27H27N3O/c1-3-4-17-28-27(31)25-19-29-30(24-12-8-9-20(2)18-24)26(25)23-15-13-22(14-16-23)21-10-6-5-7-11-21/h5-16,18-19H,3-4,17H2,1-2H3,(H,28,31)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development					Assay Description Inhibition assay using hCB1.				ACS Comb Sci 14: 197-204 (2012) Article DOI: 10.1021/co200147y BindingDB Entry DOI: 10.7270/Q22J69G1
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