BDBM50459778 Ascofuranone::US11565996, Compound Ascochlorin

SMILES [H][C@]1(CC(=O)C(C)(C)O1)C(\C)=C\CC\C(C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O

InChI Key InChIKey=VGYPZLGWVQQOST-JUERRSSISA-N

Data  1 KI  5 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 6 hits for monomerid = 50459778   

TargetAlternative oxidase, mitochondrial(Trypanosoma brucei brucei)
University Of Sussex

Curated by ChEMBL
LigandPNGBDBM50459778(Ascofuranone | US11565996, Compound Ascochlorin)
Affinity DataKi:  0.130nMAssay Description:Inhibition of Trypanosoma brucei alternative oxidase expressed in Escherichia coli FN102 using ubiquinol-1 as substrate preincubated for 2 mins follo...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetUbiquinol oxidase 1, mitochondrial(Voodoo lily)
Alternox Scientific

US Patent
LigandPNGBDBM50459778(Ascofuranone | US11565996, Compound Ascochlorin)
Affinity DataIC50:  500nMAssay Description:Table 1 summarises the concentration of inhibitor required to reduce the respiration of purified recombinant AOX protein by 50%. Respiration was meas...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Homo sapiens (Human))
Guangxi University Of Chinese Medicine

Curated by ChEMBL
LigandPNGBDBM50459778(Ascofuranone | US11565996, Compound Ascochlorin)
Affinity DataIC50:  5.40E+3nMAssay Description:Inhibition of recombinant N-terminal His-tagged human DHODH (31 to 395 residues) expressed in Escherichia coli using DL-dihydroorotic acid as substra...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetUbiquinol oxidase 1, mitochondrial(Voodoo lily)
Alternox Scientific

US Patent
LigandPNGBDBM50459778(Ascofuranone | US11565996, Compound Ascochlorin)
Affinity DataIC50:  187nMAssay Description:Table 1 summarises the concentration of inhibitor required to reduce the respiration of purified recombinant AOX protein by 50%. Respiration was meas...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Homo sapiens (Human))
Guangxi University Of Chinese Medicine

Curated by ChEMBL
LigandPNGBDBM50459778(Ascofuranone | US11565996, Compound Ascochlorin)
Affinity DataIC50:  38nMAssay Description:Inhibition of human recombinant DHODH expressed in Escherichia coli BL21(DE3) cells by microplate reader analysisMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAlternative oxidase, mitochondrial(Trypanosoma brucei brucei)
University Of Sussex

Curated by ChEMBL
LigandPNGBDBM50459778(Ascofuranone | US11565996, Compound Ascochlorin)
Affinity DataIC50:  2nMAssay Description:Inhibition of recombinant Trypanosoma brucei brucei alternative oxidase using ubiquinol-1 as substrate incubated for 2 mins followed by substrate add...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed