Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium-dependent dopamine transporter' and Ligand = 'BDBM159338'   

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))	BDBM159338 (US9034899, 26 | US9604960, 26) Show SMILES NC(=O)c1ccc(cc1)-c1cc2CNCC(c3ccc(Cl)c(Cl)c3)c2cc1F Show InChI InChI=1S/C22H17Cl2FN2O/c23-19-6-5-14(8-20(19)24)18-11-27-10-15-7-17(21(25)9-16(15)18)12-1-3-13(4-2-12)22(26)28/h1-9,18,27H,10-11H2,(H2,26,28)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5.80	n/a	n/a	n/a	n/a	n/a	n/a
Albany Molecular Research, Inc. US Patent					Assay Description Compounds were dissolved in 100% DMSO at a concentration 100 times the desired highest assay concentration, serially diluted 1:3 in 100% DMSO, and 0....				US Patent US9604960 (2017) BindingDB Entry DOI: 10.7270/Q2QC05KM
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM159338 (US9034899, 26 | US9604960, 26) Show SMILES NC(=O)c1ccc(cc1)-c1cc2CNCC(c3ccc(Cl)c(Cl)c3)c2cc1F Show InChI InChI=1S/C22H17Cl2FN2O/c23-19-6-5-14(8-20(19)24)18-11-27-10-15-7-17(21(25)9-16(15)18)12-1-3-13(4-2-12)22(26)28/h1-9,18,27H,10-11H2,(H2,26,28)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5.80	n/a	n/a	n/a	n/a	7.9	4
Albany Molecular Research, Inc. US Patent					Assay Description Compounds were dissolved in 100% DMSO at a concentration 100 times the desired highest assay concentration, serially diluted 1:3 in 100% DMSO, and 0....				US Patent US9034899 (2015) BindingDB Entry DOI: 10.7270/Q20000VT
					More data for this Ligand-Target Pair