BDBM50185851 (R,S)-4-bromo-9a-butyl-7-hydroxy-1,2,9,9a-tetrahydrofluoren-3-one::CHEMBL209851::rac-4-bromo-9a-butyl-7-hydroxy-1,2,9,9a-tetrahydrofluoren-3-one

SMILES CCCC[C@@]12CCC(=O)C(=C1c3ccc(cc3C2)O)Br

InChI Key InChIKey=FTEBGBCQCYMDPH-UHFFFAOYSA-N

Data  4 IC50  1 EC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50185851   

TargetEstrogen receptor beta(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50185851(rac-4-bromo-9a-butyl-7-hydroxy-1,2,9,9a-tetrahydro...)
Affinity DataIC50: 1.80nMAssay Description:Binding affinity to ERbeta by scintillation proximity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetEstrogen receptor beta(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50185851(rac-4-bromo-9a-butyl-7-hydroxy-1,2,9,9a-tetrahydro...)
Affinity DataIC50: 1.80nMAssay Description:Binding affinity to human ERbetaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetEstrogen receptor beta(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50185851(rac-4-bromo-9a-butyl-7-hydroxy-1,2,9,9a-tetrahydro...)
Affinity DataEC50:  4nMAssay Description:Activity at human ERbeta transfected in HEK293 cells assessed as transactivation of alkaline phosphatase reporter geneMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetEstrogen receptor(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50185851(rac-4-bromo-9a-butyl-7-hydroxy-1,2,9,9a-tetrahydro...)
Affinity DataIC50: 141nMAssay Description:Binding affinity to human ERalphaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetEstrogen receptor(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50185851(rac-4-bromo-9a-butyl-7-hydroxy-1,2,9,9a-tetrahydro...)
Affinity DataIC50: 141nMAssay Description:Binding affinity to ERalpha by scintillation proximity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed