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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 = 'BDBM50252069'   
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))
BDBM50252069
PNG
(4-(3,4-dichlorobenzyl)-3-((methylamino)methyl)benz...)
Show SMILES CNCc1cc(ccc1Cc1ccc(Cl)c(Cl)c1)S(N)(=O)=O
Show InChI InChI=1S/C15H16Cl2N2O2S/c1-19-9-12-8-13(22(18,20)21)4-3-11(12)6-10-2-5-14(16)15(17)7-10/h2-5,7-8,19H,6,9H2,1H3,(H2,18,20,21)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 130n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of [3H]NA reuptake in human noradrenaline transporter expressed in HEK293 cells


Bioorg Med Chem Lett 18: 4018-21 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.001
BindingDB Entry DOI: 10.7270/Q2W37W4X
More data for this
Ligand-Target Pair