Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50041432'   

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))	BDBM50041432 (CHEMBL3357392) Show SMILES COCCN1CC(C1)S(=O)(=O)c1ccc2n(CCN(C)C)c(CC(C)(C)C)nc2c1 Show InChI InChI=1S/C22H36N4O3S/c1-22(2,3)14-21-23-19-13-17(7-8-20(19)26(21)10-9-24(4)5)30(27,28)18-15-25(16-18)11-12-29-6/h7-8,13,18H,9-12,14-16H2,1-6H3	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	>2.50E+4	n/a	n/a	n/a	n/a
RaQualia Pharma Inc Curated by ChEMBL					Assay Description Agonist activity at human CB1 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP production				Bioorg Med Chem Lett 25: 236-40 (2014) Article DOI: 10.1016/j.bmcl.2014.11.062 BindingDB Entry DOI: 10.7270/Q2GM88XM
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