Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium-dependent noradrenaline transporter' and Ligand = 'BDBM50182571'   

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 noradrenaline transporter (Homo sapiens (Human))	BDBM50182571 (2-pyrrolidin-1-yl-1-(4-thiophen-2-yl-phenyl)pentan...) Show SMILES CCCC(N1CCCC1)C(=O)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C19H23NOS/c1-2-6-17(20-12-3-4-13-20)19(21)16-10-8-15(9-11-16)18-7-5-14-22-18/h5,7-11,14,17H,2-4,6,12-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	370	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Displacement of [125I]RTI-55 from human NET expressed in HEK293 cells				J Med Chem 49: 1420-32 (2006) Article DOI: 10.1021/jm050797a BindingDB Entry DOI: 10.7270/Q2KK9CKB
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50182571 (2-pyrrolidin-1-yl-1-(4-thiophen-2-yl-phenyl)pentan...) Show SMILES CCCC(N1CCCC1)C(=O)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C19H23NOS/c1-2-6-17(20-12-3-4-13-20)19(21)16-10-8-15(9-11-16)18-7-5-14-22-18/h5,7-11,14,17H,2-4,6,12-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	263	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H] norepinephrine uptake into human NET expressed in HEK293 cells				J Med Chem 49: 1420-32 (2006) Article DOI: 10.1021/jm050797a BindingDB Entry DOI: 10.7270/Q2KK9CKB
					More data for this Ligand-Target Pair