Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50054738'   

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))	BDBM50054738 (CHEMBL356790 | N-(2-Benzhydryloxy-ethyl)-2,2-dimet...) Show SMILES CC(C)(CNCCCc1ccccc1)CNCCOC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H38N2O/c1-29(2,23-30-20-12-15-25-13-6-3-7-14-25)24-31-21-22-32-28(26-16-8-4-9-17-26)27-18-10-5-11-19-27/h3-11,13-14,16-19,28,30-31H,12,15,20-24H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.89E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Inhibition of [3H]5-HT reuptake at rat serotonin transporter				J Med Chem 39: 4704-16 (1997) Article DOI: 10.1021/jm960305h BindingDB Entry DOI: 10.7270/Q2QZ2BN6
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