Detailed information for compound 1900258

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 271.7 | Formula: C11H14ClN3O3
  • H donors: 2 H acceptors: 3 LogP: 3.62 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1cc(/C=N/NC(C)(C)C)c(c(c1)[N+](=O)[O-])O
  • InChi: 1S/C11H14ClN3O3/c1-11(2,3)14-13-6-7-4-8(12)5-9(10(7)16)15(17)18/h4-6,14,16H,1-3H3/b13-6+
  • InChiKey: JADVTKXABRSDLY-AWNIVKPZSA-N  

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
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.4341 0.4129
Echinococcus multilocularis lamin 0.0033 0.4341 0.3011
Schistosoma mansoni lamin 0.0033 0.4341 0.3011
Echinococcus multilocularis dna polymerase eta 0.0054 1 1
Schistosoma mansoni lamin 0.0033 0.4341 0.3011
Trypanosoma brucei DNA polymerase eta, putative 0.0054 1 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.4341 0.4129
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1904 0.1904
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.1904 0.5
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0023 0.1904 0.16
Loa Loa (eye worm) hypothetical protein 0.0054 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1904 0.1904
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1904 0.1904
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0038 0.577 0.5
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1904 0.1904
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.1904 0.1904
Loa Loa (eye worm) intermediate filament protein 0.0033 0.4341 0.4129
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1904 0.1904
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.1904 0.1904
Trichomonas vaginalis DNA polymerase eta, putative 0.0023 0.1904 0.5
Echinococcus multilocularis musashi 0.0033 0.4341 0.3011
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0023 0.1904 0.5
Schistosoma mansoni intermediate filament proteins 0.0033 0.4341 0.3011
Loa Loa (eye worm) hypothetical protein 0.0033 0.4341 0.4129
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1904 0.1904
Trypanosoma brucei unspecified product 0.0023 0.1904 0.1904
Onchocerca volvulus 0.0033 0.4341 0.5
Trypanosoma cruzi DNA polymerase eta, putative 0.0038 0.577 0.4775
Brugia malayi intermediate filament protein 0.0033 0.4341 0.4129
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1904 0.1904
Trypanosoma cruzi DNA polymerase eta, putative 0.0054 1 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0023 0.1904 0.5
Echinococcus granulosus intermediate filament protein 0.0033 0.4341 0.3011
Echinococcus granulosus dna polymerase eta 0.0054 1 1
Schistosoma mansoni DNA polymerase eta 0.0054 1 1
Onchocerca volvulus 0.0033 0.4341 0.5
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1904 0.1904
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1904 0.1904
Echinococcus granulosus lamin dm0 0.0033 0.4341 0.3011
Echinococcus multilocularis lamin dm0 0.0033 0.4341 0.3011
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0023 0.1904 0.5
Leishmania major DNA polymerase eta, putative 0.0038 0.577 0.4775
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.1904 0.5
Giardia lamblia DINP protein human, muc B family 0.0023 0.1904 0.5
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.1904 0.16
Echinococcus granulosus lamin 0.0033 0.4341 0.3011
Leishmania major DNA polymerase eta, putative 0.0054 1 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.4184 0.3966
Entamoeba histolytica deoxycytidyl transferase, putative 0.0023 0.1904 0.5
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.1904 0.1904
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1904 0.1904

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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