Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Isoform GlyT-1A of Sodium- and chloride-dependent glycine transporter 1 (GlyT-1A)' and Ligand = 'BDBM199963'   

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
Isoform GlyT-1A of Sodium- and chloride-dependent glycine transporter 1 (GlyT-1A) (Homo sapiens (Human))	BDBM199963 (US9227930, 207) Show SMILES CN(CCOc1cc2C(Cc3ccccc3)C(Cc2cc1F)N1CC(C)(O)C1)S(=O)(=O)c1cn(C)cn1 Show InChI InChI=1S/C27H33FN4O4S/c1-27(33)16-32(17-27)24-13-20-12-23(28)25(14-21(20)22(24)11-19-7-5-4-6-8-19)36-10-9-31(3)37(34,35)26-15-30(2)18-29-26/h4-8,12,14-15,18,22,24,33H,9-11,13,16-17H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG US Patent					Assay Description Radioligand binding to human GlyT1c transporter-expressing membranes was determined as described in Mezler et al., Molecular Pharmacology 74:1705-171...				US Patent US9227930 (2016) BindingDB Entry DOI: 10.7270/Q2DZ0737
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