BDBM50067771 3-(2-Methylsulfanyl-ethylsulfanyl)-propionic acid (2S,3S)-3-(4-fluoro-phenyl)-8-methyl-8-aza-bicyclo[3.2.1]oct-2-ylmethyl ester::CHEMBL422290

SMILES CSCCSCCC(=O)OC[C@@H]1C2CCC(C[C@@H]1c1ccc(F)cc1)N2C

InChI Key InChIKey=WSLCFIYYDJNWLK-KAXARAQCSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50067771   

TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Institut F£R Bioanorganische Und Radiopharmazeutische Chemie

Curated by ChEMBL
LigandPNGBDBM50067771(3-(2-Methylsulfanyl-ethylsulfanyl)-propionic acid ...)
Affinity DataIC50:  5.70nMAssay Description:The compound was tested in vitro for low binding affinity for the Dopamine transporter (DAT) using competitive binding assay.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
Institut F£R Bioanorganische Und Radiopharmazeutische Chemie

Curated by ChEMBL
LigandPNGBDBM50067771(3-(2-Methylsulfanyl-ethylsulfanyl)-propionic acid ...)
Affinity DataIC50:  29nMAssay Description:The compound was tested in vitro for binding affinity for the serotonin transporter (5-HTT) using competitive binding assay.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Institut F£R Bioanorganische Und Radiopharmazeutische Chemie

Curated by ChEMBL
LigandPNGBDBM50067771(3-(2-Methylsulfanyl-ethylsulfanyl)-propionic acid ...)
Affinity DataIC50:  0.227nMAssay Description:The compound was tested in vitro for high binding affinity for the Dopamine transporter (DAT) using competitive binding assay.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent noradrenaline transporter(Homo sapiens (Human))
Institut F£R Bioanorganische Und Radiopharmazeutische Chemie

Curated by ChEMBL
LigandPNGBDBM50067771(3-(2-Methylsulfanyl-ethylsulfanyl)-propionic acid ...)
Affinity DataIC50:  16nMAssay Description:The compound was tested in vitro for binding affinity for the norepinephrine transporter (NET) using competitive binding assay.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed