Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium- and chloride-dependent glycine transporter 1' and Ligand = 'BDBM50188370'   

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 glycine transporter 1 (Homo sapiens (Human))	BDBM50188370 (4-(4-fluoro-phenyl)-8-[2-hydroxy-2-(4-trifluoromet...) Show SMILES OC1(CCCCC1N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C27H30F4N2O2/c28-21-10-4-18(5-11-21)22-17-32-24(34)25(22)13-15-33(16-14-25)23-3-1-2-12-26(23,35)19-6-8-20(9-7-19)27(29,30)31/h4-11,22-23,35H,1-3,12-17H2,(H,32,34)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.31E+3	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at human GlyT1 by radiometric assay				Bioorg Med Chem Lett 16: 4311-5 (2006) Article DOI: 10.1016/j.bmcl.2006.05.058 BindingDB Entry DOI: 10.7270/Q2Z31Z8W
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