Detailed information for compound 1892995

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 245.231 | Formula: C13H11NO4
  • H donors: 1 H acceptors: 3 LogP: 1.6 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)Oc1ccc(cc1C(=O)O)n1cccc1
  • InChi: 1S/C13H11NO4/c1-9(15)18-12-5-4-10(8-11(12)13(16)17)14-6-2-3-7-14/h2-8H,1H3,(H,16,17)
  • InChiKey: HGKLEIBGUUABKN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.004 0.1043 0.4909
Echinococcus granulosus intermediate filament protein 0.003 0.0644 0.2989
Onchocerca volvulus 0.0033 0.0772 0.0137
Schistosoma mansoni methyl-cpg binding protein mbd 0.0019 0.0202 0.0366
Brugia malayi Bromodomain containing protein 0.0042 0.1149 0.1232
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0019 0.0202 0.0865
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0052 0.1533 0.6587
Loa Loa (eye worm) hypothetical protein 0.0078 0.2594 0.2975
Schistosoma mansoni intermediate filament proteins 0.003 0.0644 0.2432
Echinococcus granulosus fetal alzheimer antigen falz 0.0025 0.0447 0.2041
Leishmania major hypothetical protein, conserved 0.0017 0.0124 0.5
Brugia malayi Pre-SET motif family protein 0.0229 0.8718 1
Brugia malayi Pre-SET motif family protein 0.0033 0.0772 0.0795
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0033 0.0772 0.5
Loa Loa (eye worm) hypothetical protein 0.0042 0.1152 0.1322
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0066 0.2103 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0622 0.0713
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0025 0.0447 0.2041
Echinococcus granulosus histone lysine methyltransferase setb 0.0052 0.1533 0.7259
Schistosoma mansoni hypothetical protein 0.0023 0.0362 0.1112
Schistosoma mansoni bromodomain containing protein 0.007 0.2262 1
Echinococcus multilocularis lamin dm0 0.003 0.0644 0.2989
Schistosoma mansoni lamin 0.003 0.0644 0.2432
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0033 0.0772 0.3033
Loa Loa (eye worm) hypothetical protein 0.0052 0.1533 0.1758
Echinococcus granulosus lamin 0.003 0.0644 0.2989
Echinococcus multilocularis musashi 0.003 0.0644 0.2989
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0016 0.0086 0.0098
Schistosoma mansoni zinc finger protein 0.0022 0.0314 0.0891
Echinococcus granulosus methyl CpG binding domain protein 2 0.0019 0.0202 0.0865
Brugia malayi Intermediate filament tail domain containing protein 0.003 0.0644 0.0646
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.004 0.1043 0.4909
Trichomonas vaginalis set domain proteins, putative 0.0261 1 0.5
Trypanosoma brucei ISWI complex protein 0.0017 0.0124 0.5
Loa Loa (eye worm) transcription factor SMAD2 0.0132 0.4763 0.5463
Echinococcus multilocularis zinc finger protein 0.0022 0.0314 0.1405
Loa Loa (eye worm) bromodomain containing protein 0.0019 0.0229 0.0263
Loa Loa (eye worm) PHD-finger family protein 0.0023 0.0362 0.0415
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0052 0.1533 0.6587
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0025 0.0447 0.151
Echinococcus granulosus zinc finger protein 0.0022 0.0314 0.1405
Loa Loa (eye worm) hypothetical protein 0.003 0.0644 0.0739
Loa Loa (eye worm) hypothetical protein 0.0047 0.1343 0.154
Loa Loa (eye worm) MH2 domain-containing protein 0.0132 0.4763 0.5463
Brugia malayi intermediate filament protein 0.003 0.0644 0.0646
Plasmodium vivax SET domain protein, putative 0.0033 0.0772 0.5
Brugia malayi MH2 domain containing protein 0.0132 0.4763 0.5418
Echinococcus multilocularis lamin 0.003 0.0644 0.2989
Trypanosoma cruzi ISWI complex protein 0.0017 0.0124 0.5
Echinococcus granulosus lamin dm0 0.003 0.0644 0.2989
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0772 0.3033
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0052 0.1533 0.7259
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0229 0.8718 1
Brugia malayi PHD-finger family protein 0.0027 0.0552 0.054
Loa Loa (eye worm) intermediate filament protein 0.003 0.0644 0.0739
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0033 0.0772 0.3606
Brugia malayi Bromodomain containing protein 0.0083 0.2785 0.3127
Schistosoma mansoni lamin 0.003 0.0644 0.2432
Trypanosoma cruzi ISWI complex protein 0.0017 0.0124 0.5
Loa Loa (eye worm) hypothetical protein 0.0014 0.0022 0.0025
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0032 0.0724 0.3371
Schistosoma mansoni methyl-cpg binding protein mbd 0.0019 0.0202 0.0366
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.003 0.0644 0.0739
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0066 0.2103 1
Loa Loa (eye worm) hypothetical protein 0.0045 0.1258 0.1443

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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