Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50306471'   

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-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50306471 (3-(1-(2-(7-methoxybenzofuran-3-yl)ethyl)-1,2,3,6-t...) Show SMILES COc1cccc2c(CCN3CCC(=CC3)c3c[nH]c4ccccc34)coc12 |c:13| Show InChI InChI=1S/C24H24N2O2/c1-27-23-8-4-6-19-18(16-28-24(19)23)11-14-26-12-9-17(10-13-26)21-15-25-22-7-3-2-5-20(21)22/h2-9,15-16,25H,10-14H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.85	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of [3H]paroxetine from 5-HT transporter in rat frontal cortical synaptosomes				Bioorg Med Chem Lett 20: 824-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.093 BindingDB Entry DOI: 10.7270/Q2B56JVJ
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