Detailed information for compound 28752

Basic information

Technical information
  • TDR Targets ID: 28752
  • Name: 4-nitro-N-(2H-tetrazol-5-yl)pyridine-2-carbox amide
  • MW: 235.16 | Formula: C7H5N7O3
  • H donors: 2 H acceptors: 7 LogP: -0.27 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1nccc(c1)[N+](=O)[O-])Nc1n[nH]nn1
  • InChi: 1S/C7H5N7O3/c15-6(9-7-10-12-13-11-7)5-3-4(14(16)17)1-2-8-5/h1-3H,(H2,9,10,11,12,13,15)
  • InChiKey: QFEQWXIDZAGXHS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-nitro-N-(2H-tetrazol-5-yl)-2-pyridinecarboxamide
  • 4-nitro-N-(2H-1,2,3,4-tetrazol-5-yl)pyridine-2-carboxamide
  • 4-nitro-N-(2H-tetrazol-5-yl)picolinamide

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) multidrug resistance protein 3 0.0036 0.9345 0.9345
Trypanosoma brucei trans-sialidase, putative 0.0029 0.6234 0.6159
Trypanosoma brucei p-glycoprotein 0.0026 0.5131 0.5033
Echinococcus multilocularis multidrug resistance associated protein 1 0.0026 0.5131 0.5033
Plasmodium falciparum multidrug resistance protein 1 0.0036 0.9345 0.9332
Entamoeba histolytica multidrug resistance protein, putative 0.0026 0.5131 0.5131
Loa Loa (eye worm) hypothetical protein 0.0026 0.5131 0.5131
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.0036 0.9345 0.9332
Trypanosoma brucei trans-sialidase, putative 0.0029 0.6234 0.6159
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0036 0.9148 0.9148
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0014 0.0197 0.5
Entamoeba histolytica P-glyco protein 6, putative 0.0036 0.9345 0.9345
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0036 0.9345 0.9345
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0026 0.5131 0.5033
Plasmodium falciparum ubiquitin-conjugating enzyme E2 N, putative 0.0038 1 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0036 0.9345 0.9345
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0036 0.9345 0.9345
Schistosoma mansoni multidrug resistance protein 0.0036 0.9345 0.9345
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0029 0.6234 0.6159
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0026 0.5131 0.5033
Schistosoma mansoni multidrug resistance protein 0.0036 0.9345 0.9345
Trichomonas vaginalis abcb9, putative 0.0036 0.9345 0.9345
Brugia malayi ABC transporter family protein 0.0036 0.9345 0.9345
Loa Loa (eye worm) ABC transporter 0.0014 0.0197 0.0197
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0036 0.9345 0.9345
Trichomonas vaginalis ABC transporter, putative 0.0036 0.9345 0.9345
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0023 0.3885 0.3885
Entamoeba histolytica ATP-binding cassette protein, putative 0.0026 0.5131 0.5131
Onchocerca volvulus 0.0036 0.9345 0.5
Loa Loa (eye worm) ubiquitin conjugating enzyme protein 13 0.0038 1 1
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0014 0.0197 0.5
Leishmania major ubiquitin-conjugating enzyme e2, putative 0.0038 1 1
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0029 0.6234 0.6159
Entamoeba histolytica P-glycoprotein-5 0.0036 0.9345 0.9345
Echinococcus multilocularis multidrug resistance protein 1 0.0036 0.9345 0.9332
Trichomonas vaginalis ubiquitin-conjugating enzyme E2, putative 0.0038 1 1
Trypanosoma brucei multidrug resistance protein E 0.0026 0.5131 0.5033
Trypanosoma cruzi trans-sialidase, putative 0.0029 0.6234 0.6159
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0036 0.9345 0.9345
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0029 0.6234 0.6159
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0026 0.5131 0.5033
Leishmania major p-glycoprotein 0.0036 0.9345 0.9332
Echinococcus multilocularis multidrug resistance protein 1 0.0023 0.3885 0.3762
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0026 0.5131 0.5033
Leishmania major ATP-binding cassette protein subfamily C, member 6, putative 0.0026 0.5131 0.5033
Echinococcus multilocularis multidrug resistance protein 1 0.0036 0.9345 0.9332
Schistosoma mansoni multidrug resistance protein 0.0026 0.5131 0.5131
Giardia lamblia Multidrug resistance-associated protein 1 0.0026 0.5131 1
Giardia lamblia ABC transporter, putative 0.0026 0.5131 1
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0014 0.0197 0.5
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0036 0.9345 0.9345
Loa Loa (eye worm) ABC transporter 0.0014 0.0197 0.0197
Loa Loa (eye worm) ABC transporter transmembrane region family protein 0.0026 0.5131 0.5131
Brugia malayi P-glycoprotein-like protein 0.0014 0.0197 0.0197
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0036 0.9345 0.9345
Trichomonas vaginalis ABC transporter, putative 0.0036 0.9345 0.9345
Leishmania major pentamidine resistance protein 1 0.0026 0.5131 0.5033
Schistosoma mansoni smdr2 0.0036 0.9345 0.9345
Leishmania major ATP-binding cassette protein subfamily C, member 2, putative 0.0026 0.5131 0.5033
Toxoplasma gondii ubiquitin-conjugating enzyme subfamily protein 0.0038 1 1
Brugia malayi ABC transporter family protein 0.0014 0.0197 0.0197
Leishmania major ABC-thiol transporter 0.0026 0.5131 0.5033
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0036 0.9345 0.9345
Echinococcus granulosus ATP binding cassette sub family B 0.0014 0.0197 0.0197
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0014 0.0197 0.5
Trichomonas vaginalis abcb9, putative 0.0036 0.9345 0.9345
Trypanosoma cruzi trans-sialidase, putative 0.0029 0.6234 0.6159
Trypanosoma brucei trans-sialidase, putative 0.0029 0.6234 0.6159
Trypanosoma brucei trans-sialidase 0.0029 0.6234 0.6159
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0029 0.6234 0.6159
Brugia malayi ABC transporter family protein 0.0014 0.0197 0.0197
Giardia lamblia Multidrug resistance-associated protein 1 0.0026 0.5131 1
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0036 0.9345 0.9332
Loa Loa (eye worm) hypothetical protein 0.0025 0.4934 0.4934
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0036 0.9345 0.5
Entamoeba histolytica P-glycoprotein-2 0.0036 0.9345 0.9345
Trypanosoma brucei trans-sialidase, putative 0.0029 0.6234 0.6159
Brugia malayi hypothetical protein 0.0014 0.0197 0.0197
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0014 0.0197 0.5
Trypanosoma cruzi ubiquitin-conjugating enzyme E2, putative 0.0038 1 1
Schistosoma mansoni multidrug resistance protein 0.0026 0.5131 0.5131
Echinococcus granulosus multidrug resistance protein 1 0.0023 0.3885 0.3885
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0029 0.6234 0.6159
Trypanosoma cruzi ubiquitin-conjugating enzyme E2, putative 0.0038 1 1
Trichomonas vaginalis taga, putative 0.0036 0.9345 0.9345
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0036 0.9345 0.9332
Brugia malayi ABC transporter family protein 0.0014 0.0197 0.0197
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0036 0.9345 0.9345
Entamoeba histolytica P-glycoprotein 6, putative 0.0014 0.0197 0.0197
Trypanosoma cruzi trans-sialidase, putative 0.0029 0.6233 0.6157
Trichomonas vaginalis ubiquitin-conjugating enzyme E2, putative 0.0038 1 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0036 0.9345 0.9345
Loa Loa (eye worm) ABC transporter 0.0014 0.0197 0.0197
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.0036 0.9345 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0036 0.9148 0.913
Trypanosoma brucei ubiquitin-protein ligase, putative 0.0038 1 1
Trypanosoma cruzi trans-sialidase, putative 0.0029 0.6233 0.6157
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0036 0.9345 0.9345
Loa Loa (eye worm) hypothetical protein 0.0026 0.5131 0.5131
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0036 0.9345 0.9345
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0036 0.9345 0.9345
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0036 0.9345 0.9345
Echinococcus granulosus multidrug resistance protein 1 0.0036 0.9345 0.9345
Trypanosoma cruzi trans-sialidase, putative 0.0029 0.6233 0.6157
Trypanosoma cruzi trans-sialidase, putative 0.0029 0.6234 0.6159
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0036 0.9345 0.9345
Trichomonas vaginalis ABC transporter, putative 0.0036 0.9345 0.9345
Echinococcus granulosus multidrug resistance protein 1 0.0036 0.9345 0.9345
Schistosoma mansoni multidrug resistance protein 0.0014 0.0197 0.0197
Entamoeba histolytica P-glycoprotein-2 0.0036 0.9345 0.9345
Echinococcus granulosus multidrug resistance protein 1 0.0023 0.3885 0.3885
Entamoeba histolytica hypothetical protein 0.0026 0.5131 0.5131
Schistosoma mansoni ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7) 0.0014 0.0197 0.0197
Echinococcus granulosus ubiquitin conjugating enzyme E2 N 0.0038 1 1
Entamoeba histolytica ATP-binding cassette protein, putative 0.0026 0.5131 0.5131
Schistosoma mansoni ubiquitin conjugating enzyme 13 0.0038 1 1
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0036 0.9345 0.9332
Leishmania major ATP-binding cassette protein subfamily C, member 1, putative 0.0026 0.5131 0.5033
Trichomonas vaginalis abcb9, putative 0.0036 0.9345 0.9345
Loa Loa (eye worm) hypothetical protein 0.0036 0.9345 0.9345
Mycobacterium ulcerans drugs-transport transmembrane ATP-binding protein ABC transporter 0.0014 0.0197 0.5
Echinococcus granulosus multidrug resistance protein 1 0.0036 0.9345 0.9345
Brugia malayi ABC transporter transmembrane region family protein 0.0014 0.0197 0.0197
Plasmodium vivax ubiquitin-conjugating enzyme E2 N, putative 0.0038 1 1
Wolbachia endosymbiont of Brugia malayi ABC-type protease secretion system, ATPase and permease component, AprD 0.0014 0.0197 0.5
Trypanosoma cruzi multidrug resistance protein E, putative 0.0026 0.5131 0.5033
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0026 0.5131 0.5033
Entamoeba histolytica P-glycoprotein 6, putative 0.0014 0.0197 0.0197
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0029 0.6234 0.6159
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0029 0.6234 0.6159
Trichomonas vaginalis ABC transporter, putative 0.0036 0.9345 0.9345
Schistosoma mansoni smdr1 0.0014 0.0197 0.0197
Echinococcus granulosus multidrug resistance associated protein 1 0.0026 0.5131 0.5131
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0029 0.6234 0.6159
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0036 0.9345 0.9345
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0036 0.9345 0.9345
Echinococcus granulosus ATP binding cassette sub family B 0.0014 0.0197 0.0197
Entamoeba histolytica P-glycoprotein-1 0.0036 0.9345 0.9345
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0036 0.9345 0.9345
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0029 0.6234 0.6159
Wolbachia endosymbiont of Brugia malayi ABC-type multidrug transport system, ATPase and permease component 0.0014 0.0197 0.5
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0036 0.9345 0.9332
Echinococcus multilocularis ubiquitin conjugating enzyme E2 N 0.0038 1 1
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0036 0.9345 0.9345
Leishmania major p-glycoprotein e 0.0026 0.5131 0.5033
Entamoeba histolytica P-glycoprotein 5, putative 0.0036 0.9345 0.9345
Loa Loa (eye worm) hypothetical protein 0.0036 0.9345 0.9345
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0036 0.9345 0.9345
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0036 0.9345 0.9345
Brugia malayi ABC transporter 0.0014 0.0197 0.0197
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0036 0.9345 0.9345
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0036 0.9345 0.9332
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0036 0.9345 0.9345
Brugia malayi ABC transporter transmembrane region family protein 0.0026 0.5131 0.5131
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0036 0.9345 0.9345
Leishmania major ATP-binding cassette protein subfamily C, member 5, putative 0.0026 0.5131 0.5033
Schistosoma mansoni multidrug resistance protein 0.0026 0.5131 0.5131
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0036 0.9345 0.9332
Echinococcus granulosus multidrug resistance associated protein 7 0.0026 0.5131 0.5131
Brugia malayi multidrug resistance related protein 1 0.0026 0.5131 0.5131
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.0036 0.9345 0.9332
Loa Loa (eye worm) ubiquitin conjugating enzyme protein 13 0.0038 1 1
Loa Loa (eye worm) hypothetical protein 0.0014 0.0197 0.0197
Entamoeba histolytica ubiquitin-conjugating enzyme family protein 0.0038 1 1
Entamoeba histolytica ATP-binding cassette protein, putative 0.0026 0.5131 0.5131
Loa Loa (eye worm) hypothetical protein 0.0036 0.9148 0.9148
Echinococcus multilocularis multidrug resistance associated protein 7 0.0026 0.5131 0.5033
Entamoeba histolytica ATP-binding cassette protein, putative 0.0026 0.5131 0.5131
Entamoeba histolytica P-glycoprotein-2, putative 0.0036 0.9345 0.9345
Brugia malayi multidrug Resistance Protein family member (mrp-5), putative 0.0014 0.0197 0.0197
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0029 0.6234 0.6159
Mycobacterium ulcerans component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD 0.0014 0.0197 0.5
Trypanosoma brucei trans-sialidase, putative 0.0029 0.6234 0.6159
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0036 0.9345 0.9345
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0036 0.9345 0.9345
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0014 0.0197 0.0197
Brugia malayi ubiquitin conjugating enzyme protein 13 0.0038 1 1
Schistosoma mansoni multidrug resistance protein 0.0026 0.5131 0.5131
Brugia malayi multidrug resistance protein 3 0.0036 0.9345 0.9345
Trypanosoma cruzi trans-sialidase, putative 0.0029 0.6233 0.6157
Plasmodium vivax multidrug resistance protein 1, putative 0.0036 0.9345 0.9332
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0036 0.9345 0.9345
Giardia lamblia MRP-like ABC transporter 0.0026 0.5131 1
Entamoeba histolytica ABC transporter, putative 0.0026 0.5131 0.5131
Schistosoma mansoni multidrug resistance protein 0.0036 0.9345 0.9345
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0029 0.6234 0.6159
Giardia lamblia Multidrug resistance-associated protein 1 0.0025 0.4934 0.9616

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = 38 % Inhibition of passive cutaneous anaphylaxis following 10 mg/kg p.o. administration. ChEMBL. 6229634

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

1 literature reference was collected for this gene.

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