BDBM50336072 (R)-3,3,3-trifluoro-N-methyl-N-(2-(3-(1-(pyrazin-2-yl)ethyl)-1H-inden-2-yl)ethyl)propan-1-amine::CHEMBL1669411

SMILES C[C@H](C1=C(CCN(C)CCC(F)(F)F)Cc2ccccc12)c1cnccn1

InChI Key InChIKey=SQGLQUFJVYRVPS-UHFFFAOYSA-N

Data  1 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50336072   

TargetHistamine H1 receptor(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50336072((R)-3,3,3-trifluoro-N-methyl-N-(2-(3-(1-(pyrazin-2...)
Affinity DataKi:  91nMAssay 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 3A4(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50336072((R)-3,3,3-trifluoro-N-methyl-N-(2-(3-(1-(pyrazin-2...)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of CYP3A4More 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
LigandPNGBDBM50336072((R)-3,3,3-trifluoro-N-methyl-N-(2-(3-(1-(pyrazin-2...)
Affinity DataIC50: 7.22E+3nMAssay Description:Inhibition of CYP2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed