Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium-dependent dopamine transporter' and Ligand = 'BDBM50099289'   

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))	BDBM50099289 (4-(4-Chloro-phenyl)-1-methyl-piperidine-3-carboxyl...) Show SMILES CN1CC[C@@H]([C@H](C1)C(=O)NCCCCCNC(=O)\C=C\c1ccc(Cl)cc1)c1ccc(Cl)cc1 Show InChI InChI=1S/C27H33Cl2N3O2/c1-32-18-15-24(21-8-12-23(29)13-9-21)25(19-32)27(34)31-17-4-2-3-16-30-26(33)14-7-20-5-10-22(28)11-6-20/h5-14,24-25H,2-4,15-19H2,1H3,(H,30,33)(H,31,34)/b14-7+/t24-,25+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	246	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Displacement of [3H]mazindol binding to dopamine transporter (DAT) in rat synaptosomes				J Med Chem 44: 1615-22 (2001) BindingDB Entry DOI: 10.7270/Q2513ZXB
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50099289 (4-(4-Chloro-phenyl)-1-methyl-piperidine-3-carboxyl...) Show SMILES CN1CC[C@@H]([C@H](C1)C(=O)NCCCCCNC(=O)\C=C\c1ccc(Cl)cc1)c1ccc(Cl)cc1 Show InChI InChI=1S/C27H33Cl2N3O2/c1-32-18-15-24(21-8-12-23(29)13-9-21)25(19-32)27(34)31-17-4-2-3-16-30-26(33)14-7-20-5-10-22(28)11-6-20/h5-14,24-25H,2-4,15-19H2,1H3,(H,30,33)(H,31,34)/b14-7+/t24-,25+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	253	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity DA uptake into rat synaptosomes using [3H]DA				J Med Chem 44: 1615-22 (2001) BindingDB Entry DOI: 10.7270/Q2513ZXB
					More data for this Ligand-Target Pair