BDBM50178322 2-((3S,10S,13S,17S)-3,17-dihydroxy-13-methyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-10-yl)acetaldehyde::CHEMBL201364

SMILES C[C@]12CCC3C(CC=C4C[C@@H](O)CC[C@]34CC=O)C1CC[C@@H]2O

InChI Key InChIKey=MUIBEBOESLAUGZ-IHMSJTIWSA-N

Data  3 IC50  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50178322   

TargetEstrogen receptor(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50178322(2-((3S,10S,13S,17S)-3,17-dihydroxy-13-methyl-2,3,4...)
Affinity DataIC50: >1.00E+3nMAssay Description:Binding affinity to human ERalphaMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetEstrogen receptor beta(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50178322(2-((3S,10S,13S,17S)-3,17-dihydroxy-13-methyl-2,3,4...)
Affinity DataEC50: >1.00E+3nMAssay Description:Effect on transactivation of ALP gene expression in HEK293 cells transfected with hERbetaMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetEstrogen receptor(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50178322(2-((3S,10S,13S,17S)-3,17-dihydroxy-13-methyl-2,3,4...)
Affinity DataEC50: >1.00E+3nMAssay Description:Effect on transactivation of ALP gene expression in HEK293 cells transfected with hERalphaMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAndrogen receptor(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50178322(2-((3S,10S,13S,17S)-3,17-dihydroxy-13-methyl-2,3,4...)
Affinity DataIC50: >5.00E+3nMAssay Description:Inhibitory activity against ARMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetEstrogen receptor beta(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50178322(2-((3S,10S,13S,17S)-3,17-dihydroxy-13-methyl-2,3,4...)
Affinity DataIC50:  1.62E+3nMAssay Description:Binding affinity to human ERbetaMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed