Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50154235'   

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))	BDBM50154235 (8-Benzhydryl-4-(3,4-dichloro-phenyl)-1,4-diaza-bic...) Show SMILES Clc1ccc(cc1Cl)N1CCN2CC1CCC2C(c1ccccc1)c1ccccc1 |TLB:4:8:12:16.15.14,THB:17:16:12:8.9.10| Show InChI InChI=1S/C26H26Cl2N2/c27-23-13-11-21(17-24(23)28)30-16-15-29-18-22(30)12-14-25(29)26(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-11,13,17,22,25-26H,12,14-16,18H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.34E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of [3H]citalopram binding to serotonin transporter of rat cerebral cortex				J Med Chem 47: 5101-13 (2004) Article DOI: 10.1021/jm049796t BindingDB Entry DOI: 10.7270/Q2HQ40P0
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