Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50313273'   

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 (Homo sapiens (Human))	BDBM50313273 (1-benzyl-N-(3-(4-(2,3-dichlorophenyl)piperazin-1-y...) Show SMILES Cc1c(cc(-c2ccccc2)n1Cc1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl Show InChI InChI=1S/C32H34Cl2N4O/c1-24-27(22-30(26-12-6-3-7-13-26)38(24)23-25-10-4-2-5-11-25)32(39)35-16-9-17-36-18-20-37(21-19-36)29-15-8-14-28(33)31(29)34/h2-8,10-15,22H,9,16-21,23H2,1H3,(H,35,39)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	125	n/a	n/a	n/a	n/a	n/a	n/a
Green Cross Corporation Curated by ChEMBL					Assay Description Displacement of [3H]imipramine from human SERT expressed in HEK293 cells after 30 mins by rapid filtration assay				Bioorg Med Chem Lett 20: 1705-11 (2010) Article DOI: 10.1016/j.bmcl.2010.01.093 BindingDB Entry DOI: 10.7270/Q2SN093C
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