BDBM50138886 2,4-diisobutylamino-6-isopentylpyrimidine::CHEMBL347927::N*2*,N*4*-Diisobutyl-6-(3-methyl-butyl)-pyrimidine-2,4-diamine

SMILES CC(C)CCc1cc(NCC(C)C)nc(NCC(C)C)n1

InChI Key InChIKey=FELVKNQXOFEZOY-UHFFFAOYSA-N

Data  6 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50138886   

TargetEstrogen receptor beta(Human)
University of Illinois At Urbana-Champaign

Curated by ChEMBL
LigandPNGBDBM50138886(N*2*,N*4*-Diisobutyl-6-(3-methyl-butyl)-pyrimidine...)
Affinity DataIC50: 1.00E+6nMAssay Description:Antagonist activity at ERbeta in human HEC1 cells assessed as inhibition of estrogen-induced transcriptional activity after 24 hrs by reporter gene a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetEstrogen receptor(Human)
University of Illinois At Urbana-Champaign

Curated by ChEMBL
LigandPNGBDBM50138886(N*2*,N*4*-Diisobutyl-6-(3-methyl-butyl)-pyrimidine...)
Affinity DataIC50: 3.10E+3nMAssay Description:Antagonist activity at ERalpha in human HEC1 cells assessed as inhibition of estrogen-induced transcriptional activity after 24 hrs by reporter gene ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetEstrogen receptor(Human)
University of Illinois At Urbana-Champaign

Curated by ChEMBL
LigandPNGBDBM50138886(N*2*,N*4*-Diisobutyl-6-(3-methyl-butyl)-pyrimidine...)
Affinity DataKi:  2.80E+3nMAssay Description:Binding affinity to ERalpha assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 by TR-FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetEstrogen receptor beta(Human)
University of Illinois At Urbana-Champaign

Curated by ChEMBL
LigandPNGBDBM50138886(N*2*,N*4*-Diisobutyl-6-(3-methyl-butyl)-pyrimidine...)
Affinity DataKi:  2.80E+3nMAssay Description:Binding affinity to ERbeta assessed as inhibition of steroid receptor coactivator 2 interaction by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetEstrogen receptor(Human)
University of Illinois At Urbana-Champaign

Curated by ChEMBL
LigandPNGBDBM50138886(N*2*,N*4*-Diisobutyl-6-(3-methyl-butyl)-pyrimidine...)
Affinity DataKi:  2.90E+4nMAssay Description:Binding affinity to ERalpha assessed as inhibition of steroid receptor coactivator 2 interaction by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetEstrogen receptor beta(Human)
University of Illinois

Curated by ChEMBL
LigandPNGBDBM50138886(N*2*,N*4*-Diisobutyl-6-(3-methyl-butyl)-pyrimidine...)
Affinity DataKi:  2.90E+4nMAssay Description:Binding affinity towards estrogen receptor was determinedMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2020
Entry Details Article
PubMed
TargetEstrogen receptor(Human)
University of Illinois At Urbana-Champaign

Curated by ChEMBL
LigandPNGBDBM50138886(N*2*,N*4*-Diisobutyl-6-(3-methyl-butyl)-pyrimidine...)
Affinity DataKi:  3.00E+4nMAssay Description:Displacement of TMR-labelled ILRKLLQE peptide from His6-tagged ERalpha LBD (unknown origin) (304 to 554 residues) expressed in Escherichia coli BL21(...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/17/2020
Entry Details Article
PubMed
TargetEstrogen receptor beta(Human)
University of Illinois At Urbana-Champaign

Curated by ChEMBL
LigandPNGBDBM50138886(N*2*,N*4*-Diisobutyl-6-(3-methyl-butyl)-pyrimidine...)
Affinity DataKi: >1.00E+6nMAssay Description:Binding affinity to ERbeta assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 by TR-FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed