BDBM50216168 CHEMBL132778

SMILES C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC=C4c5cccnc5)C

InChI Key InChIKey=GYJZZAJJENTSTP-UHFFFAOYSA-N

Data  3 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50216168   

Target3-oxo-5-alpha-steroid 4-dehydrogenase 1/2(Rat)
Kingston University

Curated by ChEMBL
LigandPNGBDBM50216168(CHEMBL132778)
Affinity DataIC50: 1.00E+4nMAssay Description:Compound was tested for the inhibitory activity against Steroid 5-alpha-reductase in ratMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/29/2012
Entry Details Article
PubMed
TargetSteroid 21-hydroxylase(Human)
University of Kansas

Curated by ChEMBL
LigandPNGBDBM50216168(CHEMBL132778)
Affinity DataIC50: 0.700nMAssay 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 Depth
Date in BDB:
8/16/2020
Entry Details Article
PubMed
TargetSteroid 17-alpha-hydroxylase/17,20 lyase(Human)
University of Kansas

Curated by ChEMBL
LigandPNGBDBM50216168(CHEMBL132778)
Affinity DataIC50: 6.10nMAssay 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 Depth
Date in BDB:
8/16/2020
Entry Details Article
PubMedPDB3D3D Structure (crystal)