Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50243189'   

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))	BDBM50243189 (3beta-(4-Chlorophenyl)-2beta-[3'-(4-methylbenzyl)i...) Show SMILES CN1C2CCC1[C@H]([C@H](C2)c1ccc(Cl)cc1)c1cc(Cc2ccc(C)cc2)no1 |r,TLB:16:6:1:4.3| Show InChI InChI=1S/C25H27ClN2O/c1-16-3-5-17(6-4-16)13-20-14-24(29-27-20)25-22(18-7-9-19(26)10-8-18)15-21-11-12-23(25)28(21)2/h3-10,14,21-23,25H,11-13,15H2,1-2H3/t21?,22-,23?,25+/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	42.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Displacement of [3H]paroxetine from 5HTT				Bioorg Med Chem 16: 6682-8 (2008) Article DOI: 10.1016/j.bmc.2008.05.073 BindingDB Entry DOI: 10.7270/Q2NK3FX0
					More data for this Ligand-Target Pair