Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50330791'   

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))	BDBM50330791 (CHEMBL1277595 | N-Methyl-4-phenyl-4-(4-(2-(pyrroli...) Show SMILES CNCCCC(c1ccccc1)c1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C23H32N2O/c1-24-15-7-10-23(20-8-3-2-4-9-20)21-11-13-22(14-12-21)26-19-18-25-16-5-6-17-25/h2-4,8-9,11-14,23-24H,5-7,10,15-19H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SERT				J Med Chem 53: 7869-73 (2010) Article DOI: 10.1021/jm100666w BindingDB Entry DOI: 10.7270/Q2P84C4F
					More data for this Ligand-Target Pair