BDBM54804 2-[1-[(Z)-1-(4-bromobenzoyl)-2-(2-furyl)vinyl]-2-pyridylidene]malononitrile::2-[1-[(Z)-3-(4-bromophenyl)-1-(2-furanyl)-3-oxoprop-1-en-2-yl]-2-pyridinylidene]propanedinitrile::2-[1-[(Z)-3-(4-bromophenyl)-1-(furan-2-yl)-3-oxidanylidene-prop-1-en-2-yl]pyridin-2-ylidene]propanedinitrile::2-[1-[(Z)-3-(4-bromophenyl)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]pyridin-2-ylidene]propanedinitrile::2-{1-[(Z)-1-(4-Bromo-benzoyl)-2-furan-2-yl-vinyl]-1H-pyridin-2-ylidene}-malononitrile::MLS000589525::SMR000213014::cid_5921555

SMILES Brc1ccc(cc1)C(=O)C(=C\c1ccco1)\N1C=CC=CC1=C(C#N)C#N

InChI Key InChIKey=MTILOECLHXZTCA-UHFFFAOYSA-N

Data  6 IC50  1 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 7 hits for monomerid = 54804   

TargetKappa-type opioid receptor(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54804(2-{1-[(Z)-1-(4-Bromo-benzoyl)-2-furan-2-yl-vinyl]-...)
Affinity DataIC50: 1.54E+4nMAssay 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:
6/5/2011
Entry Details
PCBioAssay
TargetKappa-type opioid receptor(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54804(2-{1-[(Z)-1-(4-Bromo-benzoyl)-2-furan-2-yl-vinyl]-...)
Affinity DataIC50: 4.51E+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:
7/9/2011
Entry Details
PCBioAssay
TargetLarge T antigen(SV40)
Southern Research Specialized Biocontainment Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM54804(2-{1-[(Z)-1-(4-Bromo-benzoyl)-2-furan-2-yl-vinyl]-...)
Affinity DataEC50: >5.00E+4nMAssay Description:Southern Research's Specialized Biocontainment Screening Center (SRSBSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Librarie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/9/2011
Entry Details
PCBioAssay
TargetToll-like receptor 9(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM54804(2-{1-[(Z)-1-(4-Bromo-benzoyl)-2-furan-2-yl-vinyl]-...)
Affinity DataIC50: 5.31E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/4/2012
Entry Details
PCBioAssay
TargetBeta-lactamase(Pseudomonas aeruginosa)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM54804(2-{1-[(Z)-1-(4-Bromo-benzoyl)-2-furan-2-yl-vinyl]-...)
Affinity DataIC50: 1.32E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/4/2012
Entry Details
PCBioAssay
TargetBeta-lactamase(Pseudomonas aeruginosa)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM54804(2-{1-[(Z)-1-(4-Bromo-benzoyl)-2-furan-2-yl-vinyl]-...)
Affinity DataIC50: 4.47E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2013
Entry Details
PCBioAssay
TargetReceptor-interacting serine/threonine-protein kinase 2(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM54804(2-{1-[(Z)-1-(4-Bromo-benzoyl)-2-furan-2-yl-vinyl]-...)
Affinity DataIC50: 895nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2013
Entry Details
PCBioAssay