Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50310062'   

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 (Rattus norvegicus (rat))	BDBM50310062 (1-(4-((1H-1,2,4-Triazol-1-yl)methyl)-5-(4-chloroph...) Show SMILES CCNC1(CCN(CC1)C(=O)c1nn(c(c1Cn1cncn1)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(N)=O Show InChI InChI=1S/C27H27Cl3N8O2/c1-2-33-27(26(31)40)9-11-36(12-10-27)25(39)23-20(14-37-16-32-15-34-37)24(17-3-5-18(28)6-4-17)38(35-23)22-8-7-19(29)13-21(22)30/h3-8,13,15-16,33H,2,9-12,14H2,1H3,(H2,31,40)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	878	n/a	n/a	n/a	n/a	n/a	n/a
Green Cross Corporation Curated by ChEMBL					Assay Description Displacement of [3H]CP55,940 from CB1 receptor in Sprague-Dawley rat cerebellar membrane				Bioorg Med Chem 18: 1149-62 (2010) Article DOI: 10.1016/j.bmc.2009.12.040 BindingDB Entry DOI: 10.7270/Q2TD9XG2
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