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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent noradrenaline transporter' and Ligand = 'BDBM50259229'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50259229
PNG
((R,S/S,R)-syn-1-(methyl(m-tolyl)amino)-3-(methylam...)
Show SMILES CNC[C@@H](O)[C@@H](N(C)c1cccc(C)c1)c1ccccc1 |r|
Show InChI InChI=1S/C18H24N2O/c1-14-8-7-11-16(12-14)20(3)18(17(21)13-19-2)15-9-5-4-6-10-15/h4-12,17-19,21H,13H2,1-3H3/t17-,18+/m1/s1
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Article
PubMed
n/an/a 61n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells


Bioorg Med Chem Lett 19: 2464-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.054
BindingDB Entry DOI: 10.7270/Q2T43V1C
More data for this
Ligand-Target Pair