Detailed information for compound 870783

Basic information

Technical information
  • TDR Targets ID: 870783
  • Name: 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N- [(4-ethylphenyl)methylideneamino]acetamide
  • MW: 316.315 | Formula: C14H16N6O3
  • H donors: 4 H acceptors: 6 LogP: 1.24 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCc1ccc(cc1)C=NNC(=O)CNc1nnc(nc1O)O
  • InChi: 1S/C14H16N6O3/c1-2-9-3-5-10(6-4-9)7-16-18-11(21)8-15-12-13(22)17-14(23)20-19-12/h3-7H,2,8H2,1H3,(H,15,19)(H,18,21)(H2,17,20,22,23)/b16-7+
  • InChiKey: HZCTWVVGNJLFQP-FRKPEAEDSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(4-ethylphenyl)methyleneamino]acetamide
  • 2-[(3,5-diketo-2H-1,2,4-triazin-6-yl)amino]-N-[(4-ethylbenzylidene)amino]acetamide
  • 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(4-ethylphenyl)methylideneamino]ethanamide
  • ZINC00055828
  • ST022211

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
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0383 0.1088 0.482
Toxoplasma gondii hypothetical protein 0.0383 0.1088 0.5
Echinococcus multilocularis carbonic anhydrase II 0.0677 0.2257 1
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0383 0.1088 0.482
Schistosoma mansoni carbonic anhydrase-related 0.0383 0.1088 0.1088
Mycobacterium ulcerans carbonic anhydrase 0.2128 0.8009 0.8009
Onchocerca volvulus 0.0368 0.1029 1
Echinococcus granulosus carbonic anhydrase 0.0383 0.1088 0.482
Brugia malayi Peptidase family M1 containing protein 0.0368 0.1029 0.4559
Echinococcus multilocularis aminopeptidase N 0.0368 0.1029 0.4559
Onchocerca volvulus Putative sulfate transporter 0.0202 0.0372 0.3619
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0383 0.1088 0.482
Plasmodium falciparum carbonic anhydrase 0.0383 0.1088 0.5
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0677 0.2257 0.6267
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0677 0.2257 1
Mycobacterium leprae CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE) 0.263 1 1
Schistosoma mansoni carbonic anhydrase-related 0.0383 0.1088 0.1088
Loa Loa (eye worm) peptidase family M1 containing protein 0.0297 0.0751 0.2084
Echinococcus granulosus carbonic anhydrase II 0.0677 0.2257 1
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0111 0.001 0.001
Brugia malayi Putative carbonic anhydrase 5 precursor 0.0677 0.2257 1
Echinococcus granulosus carbonic anhydrase 0.0383 0.1088 0.482
Leishmania major carbonic anhydrase-like protein 0.0677 0.2257 0.2257
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0383 0.1088 0.3021
Echinococcus multilocularis carbonic anhydrase 0.0383 0.1088 0.482
Schistosoma mansoni intracisternal A-particle retropepsin (A02 family) 0.1347 0.4911 0.4911
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0677 0.2257 1
Schistosoma mansoni carbonic anhydrase-related 0.0383 0.1088 0.1088
Onchocerca volvulus 0.0202 0.0372 0.3619
Trichomonas vaginalis conserved hypothetical protein 0.2128 0.8009 1
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0677 0.2257 0.2257
Loa Loa (eye worm) hypothetical protein 0.0383 0.1088 0.3021
Echinococcus granulosus aminopeptidase N 0.0368 0.1029 0.4559
Trichomonas vaginalis conserved hypothetical protein 0.2128 0.8009 1
Loa Loa (eye worm) carbonic anhydrase 3 0.0677 0.2257 0.6267
Echinococcus multilocularis carbonic anhydrase 0.0383 0.1088 0.482
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0383 0.1088 0.482
Echinococcus multilocularis carbonic anhydrase 0.0383 0.1088 0.482
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0383 0.1088 0.482
Echinococcus granulosus carbonic anhydrase 0.0383 0.1088 0.482
Loa Loa (eye worm) hypothetical protein 0.1016 0.3601 1
Loa Loa (eye worm) hypothetical protein 0.0259 0.06 0.1665
Mycobacterium tuberculosis Beta-carbonic anhydrase 0.0963 0.3389 0.5922
Leishmania major carbonic anhydrase family protein, putative 0.263 1 1
Schistosoma mansoni family A2 unassigned peptidase (A02 family) 0.0245 0.0542 0.0542
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0677 0.2257 1
Schistosoma mansoni carbonic anhydrase 0.263 1 1
Mycobacterium ulcerans carbonic anhydrase 0.263 1 1
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0677 0.2257 0.2257
Mycobacterium tuberculosis Beta-carbonic anhydrase CanB 0.1465 0.538 1
Schistosoma mansoni hypothetical protein 0.0383 0.1088 0.1088
Trypanosoma brucei carbonic anhydrase-like protein 0.0677 0.2257 1
Loa Loa (eye worm) hypothetical protein 0.033 0.0878 0.2438
Mycobacterium tuberculosis Probable transmembrane carbonic anhydrase (carbonate dehydratase) (carbonic dehydratase) 0.1398 0.5116 0.946
Loa Loa (eye worm) hypothetical protein 0.0383 0.1088 0.3021
Schistosoma mansoni carbonic anhydrase 0.0383 0.1088 0.1088

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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