Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent dopamine transporter' and Ligand = 'BDBM50455436'   

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))	BDBM50455436 (CHEMBL2112930) Show SMILES C(CC1CCN(C\C=C\c2ccccc2)CC1)OC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H33NO/c1-4-11-25(12-5-1)13-10-21-30-22-18-26(19-23-30)20-24-31-29(27-14-6-2-7-15-27)28-16-8-3-9-17-28/h1-17,26,29H,18-24H2/b13-10+	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibitory activity against dopamine transporter (DAT) labeled with [3H]-WIN- 35,428 in rat brain striatal membrane.				J Med Chem 41: 699-705 (1998) Article DOI: 10.1021/jm970595h BindingDB Entry DOI: 10.7270/Q247491Z
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