Detailed information for compound 781025

Basic information

Technical information
  • TDR Targets ID: 781025
  • Name: 6-acetyl-7-hydroxy-4,8-dimethylchromen-2-one
  • MW: 232.232 | Formula: C13H12O4
  • H donors: 1 H acceptors: 3 LogP: 2.07 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=c1cc(C)c2c(o1)c(C)c(c(c2)C(=O)C)O
  • InChi: 1S/C13H12O4/c1-6-4-11(15)17-13-7(2)12(16)10(8(3)14)5-9(6)13/h4-5,16H,1-3H3
  • InChiKey: ZHNUBTVEXMINJU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 6-acetyl-7-hydroxy-4,8-dimethyl-chromen-2-one
  • 6-acetyl-7-hydroxy-4,8-dimethyl-2-chromenone
  • 6-acetyl-7-hydroxy-4,8-dimethyl-coumarin
  • 6-ethanoyl-7-hydroxy-4,8-dimethyl-chromen-2-one
  • ZINC00069974
  • A1861/0078264

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.005 0.0966 0.1122
Entamoeba histolytica CAAX prenyl protease family 0.0092 0.2984 1
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0163 0.6428 0.7465
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0966 0.1122
Brugia malayi Glycosyl hydrolases family 31 protein 0.0036 0.0304 0.0353
Echinococcus granulosus CAAX prenyl protease 2 0.0092 0.2984 0.4643
Schistosoma mansoni alpha glucosidase 0.0036 0.0304 0.0571
Trichomonas vaginalis Clan U, family U48, CaaX prenyl peptidase 2-like 0.0092 0.2984 0.2764
Echinococcus multilocularis neutral alpha glucosidase AB 0.0036 0.0304 0.0474
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0036 0.0304 0.0353
Schistosoma mansoni family U48 unassigned peptidase (U48 family) 0.0092 0.2984 0.5597
Schistosoma mansoni family U48 unassigned peptidase (U48 family) 0.0092 0.2984 0.5597
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0966 0.1122
Schistosoma mansoni alpha-glucosidase 0.014 0.5332 1
Trypanosoma brucei CAAX amino terminal protease, putative 0.0092 0.2984 1
Schistosoma mansoni hypothetical protein 0.0034 0.0204 0.0383
Onchocerca volvulus 0.0094 0.311 0.311
Trypanosoma cruzi peptidase with unknown catalytic mechanism (family U48) 0.0092 0.2984 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0204 0.0237
Echinococcus multilocularis lysosomal alpha glucosidase 0.0163 0.6428 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0966 0.1122
Trypanosoma cruzi CAAX prenyl protease 2, putative 0.0092 0.2984 1
Leishmania major CAAX prenyl protease 2, putative,peptidase with unknown catalytic mechanism (family U48) 0.0092 0.2984 1
Brugia malayi CAAX amino terminal protease family protein 0.0092 0.2984 0.3466
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0204 0.0237
Brugia malayi Pre-SET motif family protein 0.0208 0.8611 1
Plasmodium vivax SET domain protein, putative 0.003 0 0.5
Trichomonas vaginalis set domain proteins, putative 0.0237 1 1
Echinococcus granulosus neutral alpha glucosidase AB 0.0036 0.0304 0.0474
Echinococcus granulosus lysosomal alpha glucosidase 0.0163 0.6428 1
Echinococcus multilocularis lysosomal alpha glucosidase 0.0163 0.6428 1
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0208 0.8611 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0163 0.6428 0.7465
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0036 0.0304 1
Echinococcus multilocularis CAAX prenyl protease 2 0.0092 0.2984 0.4643
Loa Loa (eye worm) hypothetical protein 0.0092 0.2984 0.3466
Schistosoma mansoni alpha-glucosidase 0.014 0.5332 1
Giardia lamblia Hypothetical protein 0.0092 0.2984 0.5

Activities

No activities found for this compound.

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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