Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium-dependent dopamine transporter' and Ligand = 'BDBM50001203'   

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))	BDBM50001203 (CHEMBL2112788) Show SMILES C[C@H]1CN(CCCn2c3ccccc3c3cc(ccc23)[N+]([O-])=O)C[C@H](C)N1 |r| Show InChI InChI=1S/C21H26N4O2/c1-15-13-23(14-16(2)22-15)10-5-11-24-20-7-4-3-6-18(20)19-12-17(25(26)27)8-9-21(19)24/h3-4,6-9,12,15-16,22H,5,10-11,13-14H2,1-2H3/t15-,16-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	109	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse-Intramural Research Program Curated by ChEMBL					Assay Description Binding affinity Sprague-Dawley rats using [3H]WIN-35428 ligand				J Med Chem 42: 4446-55 (1999) BindingDB Entry DOI: 10.7270/Q2NS0VMV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50001203 (CHEMBL2112788) Show SMILES C[C@H]1CN(CCCn2c3ccccc3c3cc(ccc23)[N+]([O-])=O)C[C@H](C)N1 |r| Show InChI InChI=1S/C21H26N4O2/c1-15-13-23(14-16(2)22-15)10-5-11-24-20-7-4-3-6-18(20)19-12-17(25(26)27)8-9-21(19)24/h3-4,6-9,12,15-16,22H,5,10-11,13-14H2,1-2H3/t15-,16-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	111	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse-Intramural Research Program Curated by ChEMBL					Assay Description Inhibition of Dopamine uptake in male Sprague-Dawley rats using [3H]DA ligand				J Med Chem 42: 4446-55 (1999) BindingDB Entry DOI: 10.7270/Q2NS0VMV
					More data for this Ligand-Target Pair