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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 = 'BDBM50300520'   
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))
BDBM50300520
PNG
((1S,2R)-1-(7-chloro-1H-indol-1-yl)-1-(3-fluorophen...)
Show SMILES CNC[C@@H](O)[C@H](c1cccc(F)c1)n1ccc2cccc(Cl)c12 |r|
Show InChI InChI=1S/C18H18ClFN2O/c1-21-11-16(23)18(13-5-2-6-14(20)10-13)22-9-8-12-4-3-7-15(19)17(12)22/h2-10,16,18,21,23H,11H2,1H3/t16-,18+/m1/s1
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Similars

Article
PubMed
n/an/a 21n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


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


Bioorg Med Chem Lett 19: 5807-10 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.050
BindingDB Entry DOI: 10.7270/Q2H70FV8
More data for this
Ligand-Target Pair