BDBM158505 US9034854, E4::US9040509, E4::US9561238, E4

SMILES C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1[C@H]([C@H]([C@@H]2O)O)O)O

InChI Key InChIKey=AJIPIJNNOJSSQC-UHFFFAOYSA-N

Data  6 KI

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 158505   

TargetEstrogen receptor(Human)
Pantarhei Bioscience

US Patent
LigandPNGBDBM158505(US9034854, E4 | US9561238, E4 | US9040509, E4)
Affinity DataKi:  4.90nM ΔG°:  -11.3kcal/molepH: 7.5 T: 2°CAssay Description:The method employed was adapted from the scientific literature and described in detail by Osbourn et al. (1993, Biochemistry, 32, 6229-6236). Recombi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/23/2015
Entry Details
Go to US Patent
PDB3D3D Structure (crystal)
TargetEstrogen receptor(Human)
Pantarhei Bioscience

US Patent
LigandPNGBDBM158505(US9034854, E4 | US9561238, E4 | US9040509, E4)
Affinity DataKi:  4.90nM ΔG°:  -11.3kcal/molepH: 7.5 T: 2°CAssay Description:The method employed was adapted from the scientific literature and described in detail by Osboum et al. (1993, Biochemistry, 32, 6229-6236). Recombin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/14/2015
Entry Details
Go to US Patent
PDB3D3D Structure (crystal)
TargetEstrogen receptor(Human)
Pantarhei Bioscience

US Patent
LigandPNGBDBM158505(US9034854, E4 | US9561238, E4 | US9040509, E4)
Affinity DataKi:  4.90nMpH: 7.5Assay Description:The method employed was adapted from the scientific literature and described in detail by Osbourn et al. (1993, Biochemistry, 32, 6229-6236). Recombi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/3/2018
Entry Details
Go to US Patent
PDB3D3D Structure (crystal)
TargetEstrogen receptor beta(Human)
Pantarhei Bioscience

US Patent
LigandPNGBDBM158505(US9034854, E4 | US9561238, E4 | US9040509, E4)
Affinity DataKi:  19nM ΔG°:  -10.5kcal/molepH: 7.5 T: 2°CAssay Description:The method employed was adapted from the scientific literature and described in detail by Osbourn et al. (1993, Biochemistry, 32, 6229-6236). Recombi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/23/2015
Entry Details
Go to US Patent

TargetEstrogen receptor beta(Human)
Pantarhei Bioscience

US Patent
LigandPNGBDBM158505(US9034854, E4 | US9561238, E4 | US9040509, E4)
Affinity DataKi:  19nM ΔG°:  -10.5kcal/molepH: 7.5 T: 2°CAssay Description:The method employed was adapted from the scientific literature and described in detail by Osboum et al. (1993, Biochemistry, 32, 6229-6236). Recombin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/14/2015
Entry Details
Go to US Patent

TargetEstrogen receptor beta(Human)
Pantarhei Bioscience

US Patent
LigandPNGBDBM158505(US9034854, E4 | US9561238, E4 | US9040509, E4)
Affinity DataKi:  19nMpH: 7.5Assay Description:The method employed was adapted from the scientific literature and described in detail by Osbourn et al. (1993, Biochemistry, 32, 6229-6236). Recombi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/3/2018
Entry Details
Go to US Patent