BDBM50476261 4-(1-Methylpyridinium)Phenylmethanethiosulphonate Iodide::CHEMBL224093

SMILES C[n+]1ccc(cc1)-c1ccc(SS(C)(=O)=O)cc1

InChI Key InChIKey=MBDKSJOJOZHEQU-UHFFFAOYSA-M

Data  1 KI  2 EC50

  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 3 hits for monomerid = 50476261   

TargetSodium-dependent serotonin transporter(Human)
Purdue University

Curated by ChEMBL
LigandPNGBDBM50476261(CHEMBL224093 | 4-(1-Methylpyridinium)Phenylmethane...)
Affinity DataEC50:  3.16E+4nMAssay Description:Decrease in [3H]5-HT uptake at human SERT W103C mutant transfected in HEK293 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2020
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Purdue University

Curated by ChEMBL
LigandPNGBDBM50476261(CHEMBL224093 | 4-(1-Methylpyridinium)Phenylmethane...)
Affinity DataEC50:  3.98E+3nMAssay Description:Decrease in [3H]5-HT uptake at human SERT G498C mutant transfected in HEK293 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2020
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Purdue University

Curated by ChEMBL
LigandPNGBDBM50476261(CHEMBL224093 | 4-(1-Methylpyridinium)Phenylmethane...)
Affinity DataKi:  1.30E+6nMAssay Description:Inhibition of [3H]5-HT uptake at human SERT C109A mutant transfected in HEK cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2020
Entry Details Article
PubMed