Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50172784'   

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))	BDBM50172784 (1-(3-Chloro-phenyl)-3-(3-methylamino-propyl)-3,4-d...) Show SMILES CNCCCC1Cc2ccccc2N(C1=O)c1cccc(Cl)c1 Show InChI InChI=1S/C19H21ClN2O/c1-21-11-5-7-15-12-14-6-2-3-10-18(14)22(19(15)23)17-9-4-8-16(20)13-17/h2-4,6,8-10,13,15,21H,5,7,11-12H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Eli Lilly and Company Ltd Curated by ChEMBL					Assay Description Inhibitio of monoamine reuptake at serotonin transporter				Bioorg Med Chem Lett 15: 4432-7 (2005) Article DOI: 10.1016/j.bmcl.2005.07.038 BindingDB Entry DOI: 10.7270/Q2G44PTW
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