Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent dopamine transporter' and Ligand = 'BDBM50148379'   

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 dopamine transporter (Homo sapiens (Human))	BDBM50148379 (4-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...) Show SMILES CNCC[C@H](Oc1ccc(O)c2ccccc12)c1cccs1 Show InChI InChI=1S/C18H19NO2S/c1-19-11-10-17(18-7-4-12-22-18)21-16-9-8-15(20)13-5-2-3-6-14(13)16/h2-9,12,17,19-20H,10-11H2,1H3/t17-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter; Average of two experiments				Bioorg Med Chem Lett 14: 3481-6 (2004) Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH
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