BDBM50306011 CHEMBL594513::trans-4-chloro-2-(2-fluorophenylsulfonyl)-N-(4-(trifluoromethylsulfonamido)cyclohexyl)benzenesulfonamide

SMILES: Fc1ccccc1S(=O)(=O)c1cc(Cl)ccc1S(=O)(=O)N[C@H]1CC[C@@H](CC1)NS(=O)(=O)C(F)(F)F

InChI Key: InChIKey=CGGOQLAKOPWMIE-HDJSIYSDSA-N

Data: 2 KI

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 = 50306011   

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 2 (Homo sapiens (Human))	BDBM50306011 (CHEMBL594513 | trans-4-chloro-2-(2-fluorophenylsul...) Show SMILES Fc1ccccc1S(=O)(=O)c1cc(Cl)ccc1S(=O)(=O)N[C@H]1CC[C@@H](CC1)NS(=O)(=O)C(F)(F)F |r,wU:21.22,wD:24.29,(14.6,-12.36,;13.26,-11.59,;11.92,-12.36,;10.59,-11.59,;10.59,-10.05,;11.92,-9.28,;13.25,-10.04,;14.59,-9.27,;14.98,-10.75,;16.07,-9.66,;14.58,-7.73,;13.25,-6.98,;13.24,-5.44,;11.9,-4.68,;14.57,-4.66,;15.91,-5.42,;15.91,-6.96,;17.25,-7.73,;16.84,-9.21,;18.57,-8.49,;18.01,-6.39,;19.55,-6.37,;20.29,-5.03,;21.83,-5.02,;22.62,-6.34,;21.85,-7.68,;20.32,-7.7,;24.15,-6.37,;24.95,-5.05,;23.62,-4.25,;24.97,-3.51,;26.49,-5.09,;27.29,-3.77,;27.23,-6.43,;28.02,-5.12,)| Show InChI InChI=1S/C19H19ClF4N2O6S3/c20-12-5-10-17(18(11-12)33(27,28)16-4-2-1-3-15(16)21)34(29,30)25-13-6-8-14(9-7-13)26-35(31,32)19(22,23)24/h1-5,10-11,13-14,25-26H,6-9H2/t13-,14-	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	234	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human CB2 receptor				Bioorg Med Chem Lett 20: 608-11 (2010) Article DOI: 10.1016/j.bmcl.2009.11.084 BindingDB Entry DOI: 10.7270/Q2SB45V0
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50306011 (CHEMBL594513 | trans-4-chloro-2-(2-fluorophenylsul...) Show SMILES Fc1ccccc1S(=O)(=O)c1cc(Cl)ccc1S(=O)(=O)N[C@H]1CC[C@@H](CC1)NS(=O)(=O)C(F)(F)F |r,wU:21.22,wD:24.29,(14.6,-12.36,;13.26,-11.59,;11.92,-12.36,;10.59,-11.59,;10.59,-10.05,;11.92,-9.28,;13.25,-10.04,;14.59,-9.27,;14.98,-10.75,;16.07,-9.66,;14.58,-7.73,;13.25,-6.98,;13.24,-5.44,;11.9,-4.68,;14.57,-4.66,;15.91,-5.42,;15.91,-6.96,;17.25,-7.73,;16.84,-9.21,;18.57,-8.49,;18.01,-6.39,;19.55,-6.37,;20.29,-5.03,;21.83,-5.02,;22.62,-6.34,;21.85,-7.68,;20.32,-7.7,;24.15,-6.37,;24.95,-5.05,;23.62,-4.25,;24.97,-3.51,;26.49,-5.09,;27.29,-3.77,;27.23,-6.43,;28.02,-5.12,)| Show InChI InChI=1S/C19H19ClF4N2O6S3/c20-12-5-10-17(18(11-12)33(27,28)16-4-2-1-3-15(16)21)34(29,30)25-13-6-8-14(9-7-13)26-35(31,32)19(22,23)24/h1-5,10-11,13-14,25-26H,6-9H2/t13-,14-	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.62E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human CB1 receptor				Bioorg Med Chem Lett 20: 608-11 (2010) Article DOI: 10.1016/j.bmcl.2009.11.084 BindingDB Entry DOI: 10.7270/Q2SB45V0
					More data for this Ligand-Target Pair