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 = 'BDBM50335004'   

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 (attus norvegicus (Rat))	BDBM50335004 (3-Biphenyl-4-yl-4-(2-chlorophenyl)-5-methyl-4H-1,2...) Show SMILES Cc1nnc(-c2ccc(cc2)-c2ccccc2)n1-c1ccccc1Cl |(15.78,-13.83,;14.32,-13.35,;13.85,-11.89,;12.3,-11.89,;11.83,-13.35,;10.5,-14.13,;10.51,-15.67,;9.18,-16.45,;7.84,-15.68,;7.83,-14.14,;9.16,-13.36,;6.51,-16.45,;5.18,-15.69,;3.85,-16.46,;3.85,-18,;5.18,-18.77,;6.52,-18,;13.07,-14.26,;13.07,-15.79,;11.73,-16.56,;11.73,-18.1,;13.06,-18.87,;14.4,-18.09,;14.4,-16.56,;15.73,-15.79,)| Show InChI InChI=1S/C21H16ClN3/c1-15-23-24-21(25(15)20-10-6-5-9-19(20)22)18-13-11-17(12-14-18)16-7-3-2-4-8-16/h2-14H,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at GlyT1 in rat C6 cells				J Med Chem 54: 387-91 (2011) Article DOI: 10.1021/jm101031u BindingDB Entry DOI: 10.7270/Q2H9965H
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