BDBM54150 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-6-thiophen-2-yl-1H-pyrimidine-5-carbonitrile::2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-4-oxo-6-thiophen-2-yl-1H-pyrimidine-5-carbonitrile::2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-4-keto-6-(2-thienyl)-1H-pyrimidine-5-carbonitrile::2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-4-oxo-6-thiophen-2-yl-1H-pyrimidine-5-carbonitrile::2-{[2-(4-bromophenyl)-2-oxoethyl]thio}-6-oxo-4-(2-thienyl)-1,6-dihydropyrimidine-5-carbonitrile::MLS000850710::SMR000456727::cid_2727374

SMILES Brc1ccc(cc1)C(=O)CSc1nc(-c2cccs2)c(C#N)c(=O)[nH]1

InChI Key InChIKey=GZYOIVQDBARMEH-UHFFFAOYSA-N

Data  7 IC50  1 EC50

  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 = 54150   

TargetM1 family aminopeptidase(Plasmodium falciparum (isolate FcB1 / Columbia))
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM54150(MLS000850710 | 2-{[2-(4-bromophenyl)-2-oxoethyl]th...)
Affinity DataIC50: 8.88E+3nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2011
Entry Details
PCBioAssay
TargetGlycogen synthase kinase-3 beta(Human)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM54150(MLS000850710 | 2-{[2-(4-bromophenyl)-2-oxoethyl]th...)
Affinity DataEC50: >3.00E+5nMAssay Description:Keywords: GSK3beta, dose response, kinase, inhibition, HTS Assay Overview: The glycogen synthase kinase-3 beta (GSK-3b) is a known master regulator f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/29/2011
Entry Details
PCBioAssay
TargetTyrosine-protein phosphatase non-receptor type 5(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54150(MLS000850710 | 2-{[2-(4-bromophenyl)-2-oxoethyl]th...)
Affinity DataIC50: 6.89E+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:
6/19/2012
Entry Details
PCBioAssay
TargetDual specificity protein phosphatase 3(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54150(MLS000850710 | 2-{[2-(4-bromophenyl)-2-oxoethyl]th...)
Affinity DataIC50: 3.71E+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:
6/19/2012
Entry Details
PCBioAssay
TargetTyrosine-protein phosphatase non-receptor type 11(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54150(MLS000850710 | 2-{[2-(4-bromophenyl)-2-oxoethyl]th...)
Affinity DataIC50: 7.83E+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:
6/19/2012
Entry Details
PCBioAssay
TargetTyrosine-protein phosphatase non-receptor type 5(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54150(MLS000850710 | 2-{[2-(4-bromophenyl)-2-oxoethyl]th...)
Affinity DataIC50: 1.11E+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:
6/25/2012
Entry Details
PCBioAssay
TargetTyrosine-protein phosphatase non-receptor type 22(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54150(MLS000850710 | 2-{[2-(4-bromophenyl)-2-oxoethyl]th...)
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:
6/25/2012
Entry Details
PCBioAssay
TargetMajor prion protein(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM54150(MLS000850710 | 2-{[2-(4-bromophenyl)-2-oxoethyl]th...)
Affinity DataIC50: 6.13E+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:
8/8/2014
Entry Details
PCBioAssay