Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium- and chloride-dependent GABA transporter 1' and Ligand = 'BDBM50304272'   

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 GABA transporter 1 (Mus musculus)	BDBM50304272 (2-((2S,4S)-1-(4,4-diphenylbut-3-enyl)-4-hydroxypyr...) Show SMILES [#8]-[#6@H]-1-[#6]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#7](-[#6]-[#6]\[#6]=[#6](\c2ccccc2)-c2ccccc2)-[#6]-1 |r| Show InChI InChI=1S/C22H25NO3/c24-20-14-19(15-22(25)26)23(16-20)13-7-12-21(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-6,8-12,19-20,24H,7,13-16H2,(H,25,26)/t19-,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.92E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Microbiology Curated by ChEMBL					Assay Description Inhibition of GAT1 in mouse D8 cells assessed as [3H]GABA transport by liquid scintillation counting				Bioorg Med Chem 17: 6540-6 (2009) Article DOI: 10.1016/j.bmc.2009.08.010 BindingDB Entry DOI: 10.7270/Q26110DK
					More data for this Ligand-Target Pair