BDBM50456366 CHEMBL4214976

SMILES [H][C@@]12CC=C(c3cccnc3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])C\C(=N\O)[C@@]2([H])C[C@@H](O)CC[C@]12C

InChI Key InChIKey=ZKFOPNLIHMQTMV-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50456366   

TargetSteroid 21-hydroxylase(Human)
University of Kansas

Curated by ChEMBL
LigandPNGBDBM50456366(CHEMBL4214976)
Affinity DataIC50: 1.39E+3nMAssay Description:Inhibition of C-terminal His-tagged recombinant human CYP21A2deltaH mutant expressed in Escherichia coli DH5alpha assessed as decrease in progesteron...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetSteroid 17-alpha-hydroxylase/17,20 lyase(Human)
University of Kansas

Curated by ChEMBL
LigandPNGBDBM50456366(CHEMBL4214976)
Affinity DataIC50: 17nMAssay Description:Inhibition of C-terminal His-tagged recombinant human CYP17A1delta19H mutant expressed in Escherichia coli DH5alpha assessed as decrease in progester...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCytochrome P450 3A4(Human)
University of Kansas

Curated by ChEMBL
LigandPNGBDBM50456366(CHEMBL4214976)
Affinity DataIC50: 8.57E+3nMAssay Description:Inhibition of C-terminal His-tagged recombinant human CYP3A4 assessed as decrease in metabolism of luciferin isopropyl alcohol preincubated for 3 min...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed