Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50308668'   

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))	BDBM50308668 (CHEMBL591514 | N,N-Dimethyl-5-(2-fluoroethoxy)-2-(...) Show SMILES CN(C)Cc1cc(OCCF)ccc1Oc1ccc(C)cc1N Show InChI InChI=1S/C18H23FN2O2/c1-13-4-6-18(16(20)10-13)23-17-7-5-15(22-9-8-19)11-14(17)12-21(2)3/h4-7,10-11H,8-9,12,20H2,1-3H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	401	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from human cloned SERT expressed in HEK293 cells				Bioorg Med Chem 18: 236-41 (2010) Article DOI: 10.1016/j.bmc.2009.10.062 BindingDB Entry DOI: 10.7270/Q2348KFT
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