BDBM50014558 ALOSETRON::CHEBI:253342::Lotronex::US9045501, Alosetron

SMILES Cc1[nH]cnc1CN1CCc2c(C1=O)c1ccccc1n2C

InChI Key InChIKey=JSWZEAMFRNKZNL-UHFFFAOYSA-N

Data  2 KI  1 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 2 hits for monomerid = 50014558   

TargetCytochrome P450 3A4(Human)
Amri

Curated by ChEMBL
LigandPNGBDBM50014558(CHEBI:253342 | Lotronex | ALOSETRON | US9045501, A...)
Affinity DataIC50: 600nMAssay Description:Inhibition of CYP3A4 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/9/2015
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 3A(Human)
Amri

Curated by ChEMBL
LigandPNGBDBM50014558(CHEBI:253342 | Lotronex | ALOSETRON | US9045501, A...)
Affinity DataKi:  0.5nMAssay Description:Displacement of [9-methyl-3H]BRL-43694 from human 5-HT3A receptor after overnight incubation by scintillation proximity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/9/2015
Entry Details Article
PubMed