BDBM22774 1,4-Benzoquinone::Benzil-related compound, 53::CHEMBL8320::benzoquinone::cid_4650::cyclohexa-2,5-diene-1,4-dione

SMILES O=C1C=CC(=O)C=C1

InChI Key InChIKey=AZQWKYJCGOJGHM-UHFFFAOYSA-N

Data  7 KI  10 IC50  1 Kd  1 Other

PDB links: 7 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 19 hits for monomerid = 22774   

TargetM-phase inducer phosphatase 2(Human)
Virginia Polytechnic Institute and State University

Curated by ChEMBL
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of histidine-tagged human recombinant Cdc25B catalytic domain expressed in Escherichia coliMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Human)
Universidade De S£O Paulo

Curated by ChEMBL
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataIC50: 3.40E+4nMAssay Description:Inhibition of human DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Blood fluke)
Universidade De S£O Paulo

Curated by ChEMBL
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataIC50: 8.80E+3nMAssay Description:Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
North-West University

Curated by ChEMBL
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataIC50: 1.02E+4nMAssay Description:Inhibition of recombinant human MAO-B expressed in baculovirus infected BTI insect cell microsomes using kynuramine as substrate after 20 mins by flu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2020
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] A(Human)
North-West University

Curated by ChEMBL
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataIC50: 4.82E+3nMAssay Description:Inhibition of recombinant human MAO-A expressed in baculovirus infected BTI insect cell microsomes using kynuramine as substrate after 20 mins by flu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2020
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase Mdm2(Human)
Kyoto University

Curated by ChEMBL
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataIC50: 1.39E+4nMAssay Description:Inhibition of biotin-labelled p53 binding to MDM2 (25 to 109 residues) (unknown origin) by surface plasmon resonance methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/2/2019
Entry Details Article
PubMed
TargetDual specificity protein phosphatase 6(Rat)
Virginia Polytechnic Institute and State University

Curated by ChEMBL
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of histidine-tagged rat recombinant MKP3 catalytic domain expressed in Escherichia coli BL21(DE3)More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetDual specificity protein phosphatase 1(Mouse)
Virginia Polytechnic Institute and State University

Curated by ChEMBL
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of histidine-tagged mouse MKP1 catalytic domain expressed in human Hela cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCaspase-1(Human)
RhóNe-Poulenc Rorer Central Research

Curated by ChEMBL
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataIC50: 3.00E+3nMAssay Description:Inhibitory activity against IL-1 beta converting enzyme was evaluated.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCarbon monoxide dehydrogenase small chain(Oligotropha carboxidovorans)
University of California Riverside

LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataKd:  4.76E+4nMAssay Description:Inhibition of CODH by Diphenyliodomium chloride. Inactivation of the FAD cofactor of CODH was accomplished by covalent modification of the flavin wi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2013
Entry Details Article
PubMed
TargetDNA dC->dU-editing enzyme APOBEC-3G(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataIC50: 3.61E+4nMT: 2°CAssay 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:
8/3/2011
Entry Details
PCBioAssay
TargetIndoleamine 2,3-dioxygenase 1(Human)
Bryn Mawr College

LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DatapH: 6.5 T: 2°CAssay Description:The IC50 inhibition assays were performed in a 96-well microtiter plate format using purified recombinant IDO, which was added to the substrate, L-tr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2008
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
University of Mississippi

LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataKi:  955nMAssay Description:CE inhibition was determined using a spectrophotometric multiwell plate assay with o-NPA as a substrate. The rate of change in absorbance at 420 nm w...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/15/2008
Entry Details Article
PubMed
TargetCholinesterase(Human)
University of Mississippi

LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataKi:  2.05E+3nMAssay Description:CE inhibition was determined using a spectrophotometric multiwell plate assay with o-NPA as a substrate. The rate of change in absorbance at 420 nm w...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/15/2008
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] A(Human)
North-West University

Curated by ChEMBL
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataKi:  9.62E+3nMAssay Description:Competitive inhibition of human brain mitochondria MAO-A using kynuramine as substrate by Lineweaver-Burk analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2020
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
North-West University

Curated by ChEMBL
LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataKi:  2.03E+4nMAssay Description:Non-competitive inhibition of human brain mitochondria MAO-B using kynuramine as substrate by Lineweaver-Burk analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2020
Entry Details Article
PubMed
TargetCoagulation factor XII(Human)
University of Mississippi

LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataKi: >1.00E+5nMAssay Description:CE inhibition was determined using a spectrophotometric multiwell plate assay with o-NPA as a substrate. The rate of change in absorbance at 420 nm w...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/15/2008
Entry Details Article
PubMed
TargetLiver carboxylesterase 1(Rabbit)
University of Mississippi

LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataKi: >1.00E+5nMAssay Description:CE inhibition was determined using a spectrophotometric multiwell plate assay with o-NPA as a substrate. The rate of change in absorbance at 420 nm w...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/15/2008
Entry Details Article
PubMed
TargetLiver carboxylesterase 1(Human)
University of Mississippi

LigandPNGBDBM22774(1,4-Benzoquinone | benzoquinone | cid_4650 | CHEMB...)
Affinity DataKi: >1.00E+5nMAssay Description:CE inhibition was determined using a spectrophotometric multiwell plate assay with o-NPA as a substrate. The rate of change in absorbance at 420 nm w...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/15/2008
Entry Details Article
PubMed