Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50267405'   

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))	BDBM50267405 (CHEMBL478066 | cyclopropyl(4-(2,4,6-trichloropheny...) Show SMILES Clc1cc(Cl)c(c(Cl)c1)S(=O)(=O)N1CCN(CC1)C(=O)C1CC1 Show InChI InChI=1S/C14H15Cl3N2O3S/c15-10-7-11(16)13(12(17)8-10)23(21,22)19-5-3-18(4-6-19)14(20)9-1-2-9/h7-9H,1-6H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human recombinant CB1R expressed in CHO cells				J Med Chem 52: 2550-8 (2009) Article DOI: 10.1021/jm900063x BindingDB Entry DOI: 10.7270/Q2028RF8
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50267405 (CHEMBL478066 | cyclopropyl(4-(2,4,6-trichloropheny...) Show SMILES Clc1cc(Cl)c(c(Cl)c1)S(=O)(=O)N1CCN(CC1)C(=O)C1CC1 Show InChI InChI=1S/C14H15Cl3N2O3S/c15-10-7-11(16)13(12(17)8-10)23(21,22)19-5-3-18(4-6-19)14(20)9-1-2-9/h7-9H,1-6H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inverse agonist activity at human recombinant CB1R expressed in CHO cells assessed as increase in forskolin-stimulated cAMP level				J Med Chem 52: 2550-8 (2009) Article DOI: 10.1021/jm900063x BindingDB Entry DOI: 10.7270/Q2028RF8
					More data for this Ligand-Target Pair