Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium- and chloride-dependent glycine transporter 2' and Ligand = 'BDBM50024089'   

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 2 (Homo sapiens (Human))	BDBM50024089 (CHEMBL3325449) Show SMILES CN1CCC(CC1)N1CCC(C1)NC(=O)c1ccc(COc2ccccc2)cc1 Show InChI InChI=1S/C24H31N3O2/c1-26-14-12-22(13-15-26)27-16-11-21(17-27)25-24(28)20-9-7-19(8-10-20)18-29-23-5-3-2-4-6-23/h2-10,21-22H,11-18H2,1H3,(H,25,28)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	879	n/a	n/a	n/a	n/a	n/a	n/a
Toray Industries, Inc. Curated by ChEMBL					Assay Description Inhibition of human GlyT2 transfected in HEK293 cells assessed as [3H]glycine uptake after 2 hrs				Bioorg Med Chem Lett 24: 4603-6 (2014) Article DOI: 10.1016/j.bmcl.2014.06.059 BindingDB Entry DOI: 10.7270/Q2K64KN1
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