Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50262412'   

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))	BDBM50262412 ((S)-N-(2,3-dichlorobenzyl)-3-methyl-N-(pyrrolidin-...) Show SMILES CC(C)CC(=O)N(Cc1cccc(Cl)c1Cl)[C@H]1CCNC1 |r| Show InChI InChI=1S/C16H22Cl2N2O/c1-11(2)8-15(21)20(13-6-7-19-9-13)10-12-4-3-5-14(17)16(12)18/h3-5,11,13,19H,6-10H2,1-2H3/t13-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	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 reuptake at human serotonin transporter expressed in HEK293 cells by scintillation counting				Bioorg Med Chem Lett 18: 4308-11 (2008) Article DOI: 10.1016/j.bmcl.2008.06.078 BindingDB Entry DOI: 10.7270/Q2Q2401S
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