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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 = 'BDBM50307473'   
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))
BDBM50307473
PNG
((1S,2R)-1-(3,3-Diethyl-2,3-dihydro-1H-indol-1-yl)-...)
Show SMILES CCC1(CC)CN([C@H]([C@H](O)CNC)c2cccc(F)c2)c2ccccc12 |r|
Show InChI InChI=1S/C22H29FN2O/c1-4-22(5-2)15-25(19-12-7-6-11-18(19)22)21(20(26)14-24-3)16-9-8-10-17(23)13-16/h6-13,20-21,24,26H,4-5,14-15H2,1-3H3/t20-,21+/m1/s1
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Similars

Article
PubMed
n/an/a 150n/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


J Med Chem 53: 2051-62 (2010)


Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS
More data for this
Ligand-Target Pair