BDBM50211111 (3S,8R,9S,10S,13S,14S,17S,Z)-13-methyl-10-(prop-1-enyl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol::CHEMBL246139

SMILES C\C=C/[C@]12CC[C@H](O)CC1=CC[C@H]1[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@H]21

InChI Key InChIKey=IPSPNXNCRNDAPA-UHFFFAOYSA-N

Data  3 IC50  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50211111   

TargetEstrogen receptor beta(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50211111((3S,8R,9S,10S,13S,14S,17S,Z)-13-methyl-10-(prop-1-...)
Affinity DataIC50: 16nMAssay Description:Binding affinity to human recombinant ERbeta by scintillation proximity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2012
Entry Details Article
PubMed
TargetEstrogen receptor beta(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50211111((3S,8R,9S,10S,13S,14S,17S,Z)-13-methyl-10-(prop-1-...)
Affinity DataEC50:  21nMAssay Description:Agonist activity at human recombinant ERbeta expressed in HEK293 cells by transactivation assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2012
Entry Details Article
PubMed
TargetEstrogen receptor(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50211111((3S,8R,9S,10S,13S,14S,17S,Z)-13-methyl-10-(prop-1-...)
Affinity DataEC50:  344nMAssay Description:Agonist activity at human recombinant ERalpha expressed in HEK293 cells by transactivation assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2012
Entry Details Article
PubMed
TargetAndrogen receptor(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50211111((3S,8R,9S,10S,13S,14S,17S,Z)-13-methyl-10-(prop-1-...)
Affinity DataIC50: 718nMAssay Description:Binding affinity to androgen receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2012
Entry Details Article
PubMed
TargetEstrogen receptor(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50211111((3S,8R,9S,10S,13S,14S,17S,Z)-13-methyl-10-(prop-1-...)
Affinity DataIC50: 1.96E+3nMAssay Description:Binding affinity to human recombinant ERalpha by scintillation proximity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2012
Entry Details Article
PubMed