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 = 'BDBM50439739'   

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))	BDBM50439739 (CHEMBL2419429) Show SMILES CCc1nnc(-c2ccc(cc2)-c2ccccc2)n1-c1cccc(COC)c1C |(33.47,-40.28,;32.2,-41.15,;30.81,-40.48,;30.33,-39.02,;28.79,-39.02,;28.32,-40.49,;26.99,-41.25,;25.66,-40.47,;24.32,-41.23,;24.31,-42.77,;25.65,-43.55,;26.98,-42.78,;22.98,-43.53,;21.65,-42.75,;20.31,-43.51,;20.3,-45.05,;21.64,-45.83,;22.97,-45.06,;29.57,-41.39,;29.57,-42.93,;28.24,-43.7,;28.24,-45.24,;29.58,-46.02,;30.91,-45.24,;32.25,-46.01,;32.25,-47.55,;33.59,-48.32,;30.91,-43.69,;32.24,-42.92,)| Show InChI InChI=1S/C25H25N3O/c1-4-24-26-27-25(28(24)23-12-8-11-22(17-29-3)18(23)2)21-15-13-20(14-16-21)19-9-6-5-7-10-19/h5-16H,4,17H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Displacement of [3H]glycine from GlyT1 in rat C6 glioma cells incubated for 30 mins prior to substrate addition measured after 10 mins by scintillati...				J Med Chem 56: 5744-56 (2014) Article DOI: 10.1021/jm400383w BindingDB Entry DOI: 10.7270/Q2D79CVX
					More data for this Ligand-Target Pair