BDBM314736 US9611270, Example 33

SMILES C[C@]12CC[C@@H](C[C@@H]1/C(=N/O)/C[C@@H]3[C@@H]2CC[C@]4([C@H]3CC=C4c5cccnc5)C)O

InChI Key InChIKey=ZKFOPNLIHMQTMV-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 314736   

TargetSteroid 17-alpha-hydroxylase/17,20 lyase(Human)
University of Kansas

US Patent
LigandPNGBDBM314736(US9611270, Example 33)
Affinity DataIC50: 150nMAssay Description:Complementary assays were utilized for the quantitative comparison of compound activity data for CYP17A1 and CYP21A2. Progesterone is a substrate for...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/30/2019
Entry Details
Go to US Patent
PDB3D3D Structure (crystal)
TargetSteroid 21-hydroxylase(Human)
University of Kansas

US Patent
LigandPNGBDBM314736(US9611270, Example 33)
Affinity DataIC50: 10nMAssay Description:Complementary assays were utilized for the quantitative comparison of compound activity data for CYP17A1 and CYP21A2. Progesterone is a substrate for...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/30/2019
Entry Details
Go to US Patent