BDBM50267819 CHEMBL522945::N-(1-(3,5-bis(trifluoromethyl)phenylsulfonyl)azetidin-3-yl)-2-(4-(trifluoromethyl)phenyl)acetamide

SMILES: FC(F)(F)c1ccc(CC(=O)NC2CN(C2)S(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1

InChI Key: InChIKey=OAFBBLQLICKSQI-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50267819   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50267819 (CHEMBL522945 | N-(1-(3,5-bis(trifluoromethyl)pheny...) Show SMILES FC(F)(F)c1ccc(CC(=O)NC2CN(C2)S(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1 Show InChI InChI=1S/C20H15F9N2O3S/c21-18(22,23)12-3-1-11(2-4-12)5-17(32)30-15-9-31(10-15)35(33,34)16-7-13(19(24,25)26)6-14(8-16)20(27,28)29/h1-4,6-8,15H,5,9-10H2,(H,30,32)	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	>1.00E+4	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))	BDBM50267819 (CHEMBL522945 | N-(1-(3,5-bis(trifluoromethyl)pheny...) Show SMILES FC(F)(F)c1ccc(CC(=O)NC2CN(C2)S(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1 Show InChI InChI=1S/C20H15F9N2O3S/c21-18(22,23)12-3-1-11(2-4-12)5-17(32)30-15-9-31(10-15)35(33,34)16-7-13(19(24,25)26)6-14(8-16)20(27,28)29/h1-4,6-8,15H,5,9-10H2,(H,30,32)	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
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