BDBM50028411 3-Methoxy-13-methyl-4-nitro-6,7,8,9,11,12,13,14,15,16-decahydro-cyclopenta[a]phenanthren-17-one::CHEMBL43326

SMILES COc1ccc2[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CCc2c1[N+]([O-])=O

InChI Key InChIKey=QDFCXLJPTBSDPF-UHFFFAOYSA-N

Data  1 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 = 50028411   

TargetCytochrome P450 2D6(Human)
University of Leicester

Curated by ChEMBL
LigandPNGBDBM50028411(3-Methoxy-13-methyl-4-nitro-6,7,8,9,11,12,13,14,15...)
Affinity DataIC50: 1.96E+5nMAssay Description:Inhibitory concentration against cytochrome P450 2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed
TargetSulfotransferase 1E1(Bovine)
TBA

Curated by ChEMBL
LigandPNGBDBM50028411(3-Methoxy-13-methyl-4-nitro-6,7,8,9,11,12,13,14,15...)
Affinity DataKi:  4.30E+3nMAssay Description:Inhibition of bovine estrogen sulfotransferase by the compoundMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2012
Entry Details Article
PubMed