Detailed information for compound 822035

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 333.304 | Formula: C16H11N7O2
  • H donors: 2 H acceptors: 5 LogP: 2.4 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: [O-][N+](=O)c1cccc(c1)C=NNc1n[nH]c2c(n1)nc1c2cccc1
  • InChi: 1S/C16H11N7O2/c24-23(25)11-5-3-4-10(8-11)9-17-21-16-19-15-14(20-22-16)12-6-1-2-7-13(12)18-15/h1-9,20H,(H,21,22)/b17-9+
  • InChiKey: NNVZUKRMVGPZGA-RQZCQDPDSA-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
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0151 0.0293 0.5
Onchocerca volvulus 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Mycobacterium tuberculosis Possible transmembrane cation transporter 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Loa Loa (eye worm) potassium voltage-gated channel subfamily Q member 5 0.0151 0.0293 0.0284
Schistosoma mansoni hypothetical protein 0.3959 1 1
Echinococcus multilocularis TWiK family of potassium channels protein 7 0.0151 0.0293 0.0262
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Echinococcus multilocularis twik family of potassium channels 0.0151 0.0293 0.0262
Echinococcus multilocularis serotonin receptor 0.0127 0.0234 0.0202
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.155 0.3859 0.3853
Loa Loa (eye worm) hypothetical protein 0.0127 0.0234 0.0225
Toxoplasma gondii ion channel protein 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Loa Loa (eye worm) large conductance calcium-activated potassium channel alpha subunit ai 0.0151 0.0293 0.0284
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Loa Loa (eye worm) uncoordinated protein 58 0.0151 0.0293 0.0284
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39A 0.0151 0.0293 1
Brugia malayi hypothetical protein 0.0151 0.0293 1
Schistosoma mansoni twik family of potassium channels-related 0.0151 0.0293 0.0271
Trypanosoma cruzi ion transport protein, putative 0.0151 0.0293 0.5
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Echinococcus granulosus calcium activated potassium channel variant 0.0151 0.0293 0.0262
Echinococcus granulosus potassium channel subfamily K 0.0151 0.0293 0.0262
Echinococcus multilocularis calcium activated potassium channel variant 0.0151 0.0293 0.0262
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 38. C. elegans sup-9 ortholog 0.0151 0.0293 1
Echinococcus multilocularis potassium channel subfamily K 0.0151 0.0293 0.0262
Leishmania major potassium channel subunit-like protein 0.0151 0.0293 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 32 0.0151 0.0293 1
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Echinococcus multilocularis potassium channel subfamily K 8 0.0151 0.0293 0.0262
Schistosoma mansoni calcium-activated potassium channel 0.294 0.7403 0.7397
Brugia malayi hypothetical protein 0.0151 0.0293 1
Trypanosoma cruzi hypothetical protein, conserved 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Onchocerca volvulus 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 13 0.0151 0.0293 1
Schistosoma mansoni calcium-activated potassium channel 0.3959 1 1
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Echinococcus multilocularis Two pore potassium channel protein sup 9 0.0151 0.0293 0.0262
Loa Loa (eye worm) hypothetical protein 0.0868 0.2122 0.2115
Echinococcus multilocularis small conductance calcium activated potassium 0.3959 1 1
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Loa Loa (eye worm) hypothetical protein 0.3959 1 1
Echinococcus granulosus potassium channel subfamily K 8 0.0151 0.0293 0.0262
Giardia lamblia Hypothetical protein 0.0151 0.0293 0.5
Echinococcus granulosus potassium channel subfamily K 8 0.0151 0.0293 0.0262
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0151 0.0293 0.5
Schistosoma mansoni amine GPCR 0.033 0.0751 0.073
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Onchocerca volvulus 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Leishmania major hypothetical protein, conserved 0.0151 0.0293 0.5
Schistosoma mansoni hypothetical protein 0.0151 0.0293 0.0271
Plasmodium vivax potassium channel, putative 0.0151 0.0293 0.5
Plasmodium falciparum potassium channel 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 17 0.0151 0.0293 1
Onchocerca volvulus 0.0151 0.0293 0.5
Schistosoma mansoni calcium-activated potassium channel 0.0151 0.0293 0.0271
Echinococcus granulosus biogenic amine 5HT receptor 0.0127 0.0234 0.0202
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Schistosoma mansoni twik family of potassium channels-related 0.0151 0.0293 0.0271
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Echinococcus granulosus twik family of potassium channels 0.0151 0.0293 0.0262
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Schistosoma mansoni twik family of potassium channels-related 0.0151 0.0293 0.0271
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 28 0.0151 0.0293 1
Schistosoma mansoni twik family of potassium channels-related 0.0151 0.0293 0.0271
Toxoplasma gondii ion channel protein 0.0151 0.0293 0.5
Echinococcus granulosus Two pore potassium channel protein sup 9 0.0151 0.0293 0.0262
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 7 0.0151 0.0293 1
Mycobacterium ulcerans transmembrane cation transporter 0.0151 0.0293 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39B 0.0151 0.0293 1
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Schistosoma mansoni twik family of potassium channels-related 0.0151 0.0293 0.0271
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 30. 0.0151 0.0293 1
Schistosoma mansoni twik family of potassium channels-related 0.0151 0.0293 0.0271
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Echinococcus multilocularis twik family of potassium channels 0.0151 0.0293 0.0262
Leishmania major calcium/potassium channel (CAKC), putative 0.0151 0.0293 0.5
Loa Loa (eye worm) TWK-7 protein 0.0151 0.0293 0.0284
Schistosoma mansoni calcium-activated potassium channel 0.0151 0.0293 0.0271
Leishmania major hypothetical protein, conserved 0.0151 0.0293 0.5
Loa Loa (eye worm) TWK-28 protein 0.0151 0.0293 0.0284
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Trypanosoma cruzi hypothetical protein, conserved 0.0151 0.0293 0.5
Plasmodium vivax potassium channel, putative 0.0151 0.0293 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 19. C. elegans unc-58 ortholog 0.0151 0.0293 1
Trypanosoma cruzi ion transport protein, putative 0.0151 0.0293 0.5
Leishmania major ion transport protein-like protein 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Echinococcus granulosus twik family of potassium channels 0.0151 0.0293 0.0262
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 12 0.0151 0.0293 1
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Trypanosoma brucei calcium-activated potassium channel, putative 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Onchocerca volvulus 0.0151 0.0293 0.5
Schistosoma mansoni biogenic amine (5HT) receptor 0.0127 0.0234 0.0211
Schistosoma mansoni twik family of potassium channels-related 0.0151 0.0293 0.0271
Brugia malayi Twik (KCNK-like) family of potasium channels, alpha subunit 40 0.0151 0.0293 1
Loa Loa (eye worm) hypothetical protein 0.0048 0.0033 0.0023
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 45 0.0151 0.0293 1
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Plasmodium falciparum potassium channel 0.0151 0.0293 0.5
Echinococcus granulosus TWiK family of potassium channels protein 7 0.0151 0.0293 0.0262
Onchocerca volvulus 0.0151 0.0293 0.5
Echinococcus multilocularis serotonin receptor 0.0127 0.0234 0.0202
Loa Loa (eye worm) S-phase kinase-associated protein 1A 0.0151 0.0293 0.0284
Entamoeba histolytica calcium-gated potassium channel protein, putative 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0151 0.0293 0.5
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.1391 0.3454 0.3447
Onchocerca volvulus 0.0151 0.0293 0.5
Loa Loa (eye worm) hypothetical protein 0.0151 0.0293 0.0284
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 5 0.0151 0.0293 1
Loa Loa (eye worm) hypothetical protein 0.0127 0.0234 0.0225
Schistosoma mansoni twik family of potassium channels-related 0.0151 0.0293 0.0271
Mycobacterium ulcerans ion transport protein 0.0151 0.0293 0.5
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0151 0.0293 0.5
Onchocerca volvulus 0.0151 0.0293 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 35 0.0151 0.0293 1
Echinococcus multilocularis potassium channel subfamily K 8 0.0151 0.0293 0.0262
Brugia malayi Metabotropic glutamate receptor precursor. 0.0039 0.0009 0.0321
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 24 0.0151 0.0293 1
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 21 0.0151 0.0293 1
Trypanosoma brucei calcium/potassium channel (CAKC), putative 0.0151 0.0293 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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