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 = 'BDBM100963'   

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 (Bos taurus (Bovine))	BDBM100963 (US8524909, 45) Show SMILES COc1cc(cc(SC)c1C(=O)N[C@H]1COCC[C@@H]1NC1CCCC1)C(F)(F)F |r| Show InChI InChI=1S/C20H27F3N2O3S/c1-27-16-9-12(20(21,22)23)10-17(29-2)18(16)19(26)25-15-11-28-8-7-14(15)24-13-5-3-4-6-13/h9-10,13-15,24H,3-8,11H2,1-2H3,(H,25,26)/t14-,15-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	111	n/a	n/a	n/a	n/a	n/a	0
Hoffmann-La Roche Inc. US Patent					Assay Description Glycine uptake inhibition assay.				US Patent US8524909 (2013) BindingDB Entry DOI: 10.7270/Q2QJ7FXS
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