Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50203948'   

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))	BDBM50203948 ((S)-N-(3-chloro-2-methylbenzyl)-N-(tetrahydro-2H-p...) Show SMILES Cc1c(Cl)cccc1CN([C@H]1CCNC1)C1CCOCC1 Show InChI InChI=1S/C17H25ClN2O/c1-13-14(3-2-4-17(13)18)12-20(16-5-8-19-11-16)15-6-9-21-10-7-15/h2-4,15-16,19H,5-12H2,1H3/t16-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of [3H]5HT from human SERT expressed in HEK293 cells				Bioorg Med Chem Lett 17: 2022-5 (2007) Article DOI: 10.1016/j.bmcl.2007.01.020 BindingDB Entry DOI: 10.7270/Q20R9P2S
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