Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Transporter' and Ligand = 'BDBM50198234'   

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
Transporter (Rattus norvegicus)	BDBM50198234 (2-((5-iodothiophen-2-yl)(o-tolyloxy)methyl)morphol...) Show SMILES Cc1ccccc1OC(C1CNCCO1)c1ccc(I)s1 |w:9.15,8.8| Show InChI InChI=1S/C16H18INO2S/c1-11-4-2-3-5-12(11)20-16(13-10-18-8-9-19-13)14-6-7-15(17)21-14/h2-7,13,16,18H,8-10H2,1H3	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	71.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Degenerative Diseases Curated by ChEMBL					Assay Description Displacement of [3H]nisoxetine from NET in rat brain membranes				Bioorg Med Chem Lett 17: 533-7 (2007) Article DOI: 10.1016/j.bmcl.2006.10.018 BindingDB Entry DOI: 10.7270/Q2WS8SX8
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