Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium- and chloride-dependent taurine transporter' and Ligand = 'BDBM50195175'   

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
Sodium- and chloride-dependent taurine transporter (Homo sapiens (Human))	BDBM50195175 (CHEMBL223491 | N-((4-(3-aminoazetidine-1-carbonyl)...) Show SMILES CCCS(=O)(=O)N1CCC(CNC(=O)c2ccc(Cl)cc2Cl)(CC1)C(=O)N1CC(N)C1 Show InChI InChI=1S/C20H28Cl2N4O4S/c1-2-9-31(29,30)26-7-5-20(6-8-26,19(28)25-11-15(23)12-25)13-24-18(27)16-4-3-14(21)10-17(16)22/h3-4,10,15H,2,5-9,11-13,23H2,1H3,(H,24,27)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck and Co. Curated by ChEMBL					Assay Description Inhibition of human TauT				Bioorg Med Chem Lett 16: 5968-72 (2006) Article DOI: 10.1016/j.bmcl.2006.08.131 BindingDB Entry DOI: 10.7270/Q2C82B31
					More data for this Ligand-Target Pair