BDBM50336073 2-((2-(2-(azetidin-1-yl)ethyl)-1H-inden-3-yl)methyl)pyrazine::CHEMBL1669412

SMILES C(CC1=C(Cc2cnccn2)c2ccccc2C1)N1CCC1

InChI Key InChIKey=ADLLYWYUHVDQBH-UHFFFAOYSA-N

Data  1 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50336073   

TargetHistamine H1 receptor(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50336073(2-((2-(2-(azetidin-1-yl)ethyl)-1H-inden-3-yl)methy...)
Affinity DataKi:  4.30nMAssay Description:Binding affinity to histamine H1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50336073(2-((2-(2-(azetidin-1-yl)ethyl)-1H-inden-3-yl)methy...)
Affinity DataIC50: 8.85E+3nMAssay Description:Inhibition of CYP2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50336073(2-((2-(2-(azetidin-1-yl)ethyl)-1H-inden-3-yl)methy...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed