Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent dopamine transporter' and Ligand = 'BDBM50359612'   

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 (Rattus norvegicus (rat))	BDBM50359612 (CHEMBL1927872) Show SMILES C=CCN1[C@H]2CC[C@@H]1C\C(C2)=C/COC(c1ccccc1)c1ccccc1 |r,THB:2:3:10.9.8:6.5| Show InChI InChI=1S/C25H29NO/c1-2-16-26-23-13-14-24(26)19-20(18-23)15-17-27-25(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h2-12,15,23-25H,1,13-14,16-19H2/b20-15-/t23-,24+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	143	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New Orleans Curated by ChEMBL					Assay Description Displacement of [3H]WIN35428 from DAT in Sprague-Dawley rat brain homogenates after 1 hr by scintillation counting				Bioorg Med Chem 19: 7551-8 (2011) Article DOI: 10.1016/j.bmc.2011.10.028 BindingDB Entry DOI: 10.7270/Q2XP75CJ
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