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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium-dependent noradrenaline transporter' and Ligand = 'BDBM50297420'   
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))
BDBM50297420
PNG
((Z)-N-Methyl-2-(naphthalen-1-yloxy)-2-(thiophen-2-...)
Show SMILES CNC[C@@H]1C[C@@]1(Oc1cccc2ccccc12)c1cccs1 |r|
Show InChI InChI=1S/C19H19NOS/c1-20-13-15-12-19(15,18-10-5-11-22-18)21-17-9-4-7-14-6-2-3-8-16(14)17/h2-11,15,20H,12-13H2,1H3/t15-,19-/m0/s1
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
4.16n/an/an/an/an/an/an/an/a



Oregon State University

Curated by ChEMBL


Assay Description
Inhibition of [3H]norepinephrine reuptake at norepinephrine transporter


J Med Chem 52: 5872-9 (2009)


Article DOI: 10.1021/jm900847b
BindingDB Entry DOI: 10.7270/Q26Q1XBR
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50297420
PNG
((Z)-N-Methyl-2-(naphthalen-1-yloxy)-2-(thiophen-2-...)
Show SMILES CNC[C@@H]1C[C@@]1(Oc1cccc2ccccc12)c1cccs1 |r|
Show InChI InChI=1S/C19H19NOS/c1-20-13-15-12-19(15,18-10-5-11-22-18)21-17-9-4-7-14-6-2-3-8-16(14)17/h2-11,15,20H,12-13H2,1H3/t15-,19-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.16n/an/an/an/an/an/an/an/a



Oregon State University

Curated by ChEMBL


Assay Description
Inhibition of [3H]norepinephrine reuptake at norepinephrine transporter


J Med Chem 52: 5872-9 (2009)


Article DOI: 10.1021/jm900847b
BindingDB Entry DOI: 10.7270/Q26Q1XBR
More data for this
Ligand-Target Pair