null

SMILES: OC(=O)c1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)c2ccccc2F)cc1

InChI Key: InChIKey=XTOSTJJWYUORHI-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50419599   

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
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419599 (CHEMBL1940798) Show SMILES OC(=O)c1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)c2ccccc2F)cc1 Show InChI InChI=1S/C19H20FN3O5S/c20-16-3-1-2-4-17(16)29(27,28)23-11-9-22(10-12-23)13-18(24)21-15-7-5-14(6-8-15)19(25)26/h1-8H,9-13H2,(H,21,24)(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as decrease in epibatidine-induced calcium mobilizati...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair