Detailed information for compound 763456

Basic information

Technical information
  • TDR Targets ID: 763456
  • Name: 1-(3,4-diethoxyphenyl)-2-(5-propan-2-yl-1,3,4 -thiadiazol-2-yl)-1H-chromeno[2,3-c]pyrrole-3 ,9-dione
  • MW: 491.559 | Formula: C26H25N3O5S
  • H donors: 0 H acceptors: 4 LogP: 4.66 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1cc(ccc1OCC)C1N(c2nnc(s2)C(C)C)C(=O)c2c1c(=O)c1c(o2)cccc1
  • InChi: 1S/C26H25N3O5S/c1-5-32-18-12-11-15(13-19(18)33-6-2)21-20-22(30)16-9-7-8-10-17(16)34-23(20)25(31)29(21)26-28-27-24(35-26)14(3)4/h7-14,21H,5-6H2,1-4H3
  • InChiKey: NVTAFGRPZNKVLT-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 1-(3,4-diethoxyphenyl)-2-(5-isopropyl-1,3,4-thiadiazol-2-yl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
  • 1-(3,4-diethoxyphenyl)-2-(5-isopropyl-1,3,4-thiadiazol-2-yl)-1H-chromeno[2,3-c]pyrrole-3,9-quinone

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
Plasmodium vivax dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.0333 1 0.5
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0147 0.3444 0.8344
Onchocerca volvulus Matrilysin homolog 0.009 0.1424 1
Trichomonas vaginalis dihydropyrimidine dehydrogenase, putative 0.013 0.2847 0.5
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.013 0.2847 0.5
Toxoplasma gondii dihydroorotate dehydrogenase reveal, putative 0.0333 1 0.5
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.013 0.2847 0.5
Mycobacterium tuberculosis Probable dihydroorotate dehydrogenase PyrD 0.0333 1 1
Brugia malayi Matrixin family protein 0.0098 0.1709 0.1709
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0147 0.3444 0.8344
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.013 0.2847 0.5
Brugia malayi Muscleblind-like protein 0.015 0.3563 0.3563
Schistosoma mansoni dihydroorotate dehydrogenase 0.0333 1 1
Echinococcus granulosus muscleblind protein 0.015 0.3563 1
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.013 0.2847 0.5
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.013 0.2847 0.5
Loa Loa (eye worm) matrixin family protein 0.009 0.1424 0.3998
Leishmania major dihydroorotate dehydrogenase 0.0333 1 0.5
Trypanosoma brucei dihydroorotate dehydrogenase (fumarate) 0.0333 1 0.5
Entamoeba histolytica dihydropyrimidine dehydrogenase, putative 0.013 0.2847 0.5
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0096 0.1648 0.1403
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0333 1 1
Loa Loa (eye worm) hypothetical protein 0.015 0.3563 1
Trypanosoma cruzi dihydroorotate dehydrogenase (fumarate), putative 0.0333 1 1
Onchocerca volvulus Matrix metalloproteinase homolog 0.009 0.1424 1
Loa Loa (eye worm) hypothetical protein 0.015 0.3563 1
Echinococcus multilocularis muscleblind protein 0.015 0.3563 1
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0333 1 1
Wolbachia endosymbiont of Brugia malayi dihydroorotate dehydrogenase 2 0.0333 1 0.5
Plasmodium falciparum dihydroorotate dehydrogenase 0.0333 1 0.5
Echinococcus multilocularis muscleblind protein 1 0.015 0.3563 1
Brugia malayi Dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.0333 1 1
Mycobacterium ulcerans dihydroorotate dehydrogenase 2 0.0333 1 1
Loa Loa (eye worm) matrixin family protein 0.0098 0.1709 0.4798
Brugia malayi Zinc finger, C2H2 type family protein 0.013 0.2847 0.2847
Mycobacterium leprae Probable dihydroorotate dehydrogenase PyrD 0.0333 1 1
Brugia malayi Hemopexin family protein 0.0057 0.0285 0.0285

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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