BDBM4339 (3,4-Dihydroxybenzylidene)malononitrile::2-[(3,4-dihydroxyphenyl)methylidene]propanedinitrile::benzylidenemalononitrile (BMN) deriv. 23::cid_2052

SMILES [#8]-c1ccc(\[#6]=[#6](/C#N)C#N)cc1-[#8]

InChI Key InChIKey=FTIFYYMTIWIJAD-UHFFFAOYSA-N

Data  3 KI  7 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 9 hits for monomerid = 4339   

TargetIntestinal-type alkaline phosphatase(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM4339(2-[(3,4-dihydroxyphenyl)methylidene]propanedinitri...)
Affinity DataIC50: 1.00E+5nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, CA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/1/2011
Entry Details
PCBioAssay
TargetAlkaline phosphatase, germ cell type(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM4339(2-[(3,4-dihydroxyphenyl)methylidene]propanedinitri...)
Affinity DataIC50: 1.00E+5nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/1/2011
Entry Details
PCBioAssay
TargetAlkaline phosphatase, tissue-nonspecific isozyme(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM4339(2-[(3,4-dihydroxyphenyl)methylidene]propanedinitri...)
Affinity DataIC50: 9.97E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/1/2011
Entry Details
PCBioAssay
TargetIntestinal-type alkaline phosphatase 1(Rat)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM4339(2-[(3,4-dihydroxyphenyl)methylidene]propanedinitri...)
Affinity DataIC50: 4.22E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/1/2011
Entry Details
PCBioAssay
TargetAromatase(Human)
University of The West of Scotland

Curated by ChEMBL
LigandPNGBDBM4339(2-[(3,4-dihydroxyphenyl)methylidene]propanedinitri...)
Affinity DataIC50: 7.06E+4nMAssay Description:Inhibition of aromataseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed
TargetEpidermal growth factor receptor(Human)
University of Oxford

Curated by ChEMBL
LigandPNGBDBM4339(2-[(3,4-dihydroxyphenyl)methylidene]propanedinitri...)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of EGFR autophosphorylationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed
TargetProtein-tyrosine kinase 2-beta(Human)
Sandia National Laboratories

Curated by ChEMBL
LigandPNGBDBM4339(2-[(3,4-dihydroxyphenyl)methylidene]propanedinitri...)
Affinity DataKi:  162nMAssay Description:Inhibition of human recombinant PYK2 by ESI-MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed
TargetTyrosine-protein kinase ZAP-70(Human)
Sandia National Laboratories

Curated by ChEMBL
LigandPNGBDBM4339(2-[(3,4-dihydroxyphenyl)methylidene]propanedinitri...)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of human recombinant ZAP70 using EEEEYEEEE as substrate by ESI-MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed
TargetEpidermal growth factor receptor(Human)
University of Oxford

Curated by ChEMBL
LigandPNGBDBM4339(2-[(3,4-dihydroxyphenyl)methylidene]propanedinitri...)
Affinity DataKi:  1.10E+4nM ΔG°:  -6.69kcal/mole IC50: 3.50E+4nMpH: 7.6 T: 2°CAssay Description:The activity of EGFR, preactivated with EGF, is measured by its ability to transfer terminal phosphate from [gamma-32P]ATP to poly(GAT) substrate.More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/9/2005
Entry Details Article
PubMed