Detailed information for compound 49539

Basic information

Technical information
  • TDR Targets ID: 49539
  • Name: 6-[4-(methylamino)phenyl]-N-(2H-tetrazol-5-yl )pyridine-2-carboxamide
  • MW: 295.299 | Formula: C14H13N7O
  • H donors: 3 H acceptors: 5 LogP: 1.55 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CNc1ccc(cc1)c1cccc(n1)C(=O)Nc1n[nH]nn1
  • InChi: 1S/C14H13N7O/c1-15-10-7-5-9(6-8-10)11-3-2-4-12(16-11)13(22)17-14-18-20-21-19-14/h2-8,15H,1H3,(H2,17,18,19,20,21,22)
  • InChiKey: OGPWRZRZAFAWGJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 6-[4-(methylamino)phenyl]-N-(2H-tetrazol-5-yl)-2-pyridinecarboxamide
  • 6-[4-(methylamino)phenyl]-N-(2H-1,2,3,4-tetrazol-5-yl)pyridine-2-carboxamide
  • 6-[4-(methylamino)phenyl]-N-(2H-tetrazol-5-yl)picolinamide
  • 6-(4-methylaminophenyl)-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
  • 6-(4-methylaminophenyl)-N-(2H-tetrazol-5-yl)-2-pyridinecarboxamide
  • 6-(4-methylaminophenyl)-N-(2H-tetrazol-5-yl)picolinamide
  • 6-(4-methylaminophenyl)-N-(2H-1,2,3,4-tetrazol-5-yl)pyridine-2-carboxamide

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 falciparum flap endonuclease 1 0.0026 0.0292 1
Leishmania major 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase-1-like protein 0.0192 0.4092 0.4058
Brugia malayi Isocitrate dehydrogenase 0.0016 0.0057 0.0002
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0744 0.0692
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0057 0.0001
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0838 0.3289
Brugia malayi isocitrate dehydrogenase 0.0016 0.0057 0.0002
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0137 0.0081
Giardia lamblia Hypothetical protein 0.0266 0.5777 0.7485
Entamoeba histolytica hypothetical protein 0.0036 0.052 0.0508
Echinococcus multilocularis geminin 0.017 0.3583 0.3546
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.052 0.0466
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.052 0.0466
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0477 0.1767
Entamoeba histolytica hypothetical protein 0.0036 0.052 0.0508
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0137 0.0137
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0019 0.0137 1
Loa Loa (eye worm) hypothetical protein 0.0443 0.9826 0.9825
Loa Loa (eye worm) hypothetical protein 0.0025 0.0273 0.0218
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0026 0.0292 0.0236
Trypanosoma brucei DNA polymerase eta, putative 0.0045 0.0722 0.0722
Entamoeba histolytica DNA repair and recombination protein RAD52, putative 0.0349 0.7672 1
Trypanosoma cruzi 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative 0.0451 1 1
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0016 0.0057 0.0057
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0137 0.034
Echinococcus granulosus dna polymerase kappa 0.0019 0.0137 0.0081
Loa Loa (eye worm) hypothetical protein 0.0034 0.0477 0.0422
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0744 0.0692
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0026 0.0292 0.0236
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0744 0.0692
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0016 0.0057 0.0001
Loa Loa (eye worm) hypothetical protein 0.0259 0.5603 0.5578
Entamoeba histolytica hypothetical protein 0.0036 0.052 0.0508
Schistosoma mansoni flap endonuclease-1 0.0024 0.0235 0.0179
Entamoeba histolytica hypothetical protein 0.0099 0.1964 0.2425
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0273 0.9184
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0137 0.0081
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0137 0.0137
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0137 0.0081
Loa Loa (eye worm) hypothetical protein 0.0045 0.0722 0.0669
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0273 0.0217
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0137 0.0137
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0137 0.0137
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0137 0.0137
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0016 0.0057 0.0001
Trypanosoma cruzi 6-phosphofructo-2-kinase 1 0.0443 0.9826 0.9825
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0137 0.0137
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0137 0.0137
Trypanosoma cruzi 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative 0.0192 0.4092 0.4058
Entamoeba histolytica Flap nuclease, putative 0.0026 0.0292 0.0205
Brugia malayi hypothetical protein 0.0025 0.0273 0.091
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0137 0.0081
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0137 0.0081
Schistosoma mansoni hypothetical protein 0.017 0.3583 0.3546
Echinococcus multilocularis isocitrate dehydrogenase 0.0016 0.0057 0.0001
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0273 0.9184
Mycobacterium ulcerans fructose-2,6-bisphosphatase GpmB 0.0266 0.5777 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0137 0.0137
Giardia lamblia Flap structure-specific endonuclease 0.0026 0.0292 0.0205
Entamoeba histolytica Rad52/22 family double-strand break repair protein, putative 0.0099 0.1964 0.2425
Giardia lamblia Hypothetical protein 0.0266 0.5777 0.7485
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.052 0.0466
Loa Loa (eye worm) flap endonuclease-1 0.0026 0.0292 0.0237
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0744 0.0692
Mycobacterium ulcerans hypothetical protein 0.0266 0.5777 1
Trypanosoma cruzi DNA polymerase eta, putative 0.0045 0.0722 0.0669
Loa Loa (eye worm) isocitrate dehydrogenase 0.0016 0.0057 0.0001
Echinococcus multilocularis dna polymerase eta 0.0045 0.0722 0.0669
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0016 0.0057 0.0001
Leishmania major 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative 0.0451 1 1
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0137 0.0081
Leishmania major DNA polymerase eta, putative 0.0045 0.0722 0.0669
Loa Loa (eye worm) hypothetical protein 0.0451 1 1
Echinococcus multilocularis 6 phosphofructo 2 kinase:fructose 2 0.0451 1 1
Schistosoma mansoni hypothetical protein 0.0034 0.0477 0.0422
Leishmania major DNA polymerase kappa, putative 0.0019 0.0137 0.0081
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0273 0.9184
Trypanosoma cruzi DNA polymerase eta, putative 0.0032 0.0417 0.0361
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0057 0.0001
Giardia lamblia DNA repair protein RAD52 0.0349 0.7672 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0137 0.0137
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0137 0.0137
Mycobacterium tuberculosis Conserved hypothetical protein 0.0019 0.0137 1
Echinococcus multilocularis flap endonuclease 1 0.0026 0.0292 0.0237
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0744 0.0692
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0838 0.3289
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0057 0.0057
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0026 0.0292 0.0292
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0032 0.0417 1
Onchocerca volvulus 0.0451 1 0.5
Leishmania major hypothetical protein, conserved 0.0025 0.0273 0.0217
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0273 0.0217
Trypanosoma brucei 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative 0.0192 0.4092 0.4092
Entamoeba histolytica hypothetical protein 0.0036 0.052 0.0508
Leishmania major 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative 0.0443 0.9826 0.9825
Brugia malayi MH2 domain containing protein 0.012 0.2434 1
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0026 0.0292 0.6539
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0273 0.0273
Trypanosoma cruzi 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative 0.0451 1 1
Loa Loa (eye worm) transcription factor SMAD2 0.012 0.2434 0.2391
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0744 0.2892
Loa Loa (eye worm) hypothetical protein 0.005 0.0838 0.0786
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0744 0.0692
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0137 0.0081
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0137 0.0081
Entamoeba histolytica phosphoglycerate mutase family protein, putative 0.0266 0.5777 0.7485
Trypanosoma cruzi 6-phosphofructo-2-kinase 1 0.0443 0.9826 0.9825
Echinococcus granulosus geminin 0.017 0.3583 0.3546
Trypanosoma cruzi 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative 0.0192 0.4092 0.4058
Trypanosoma brucei unspecified product 0.0019 0.0137 0.0137
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0137 0.0081
Brugia malayi hypothetical protein 0.0016 0.0068 0.0048
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0137 0.0081
Trichomonas vaginalis flap endonuclease-1, putative 0.0026 0.0292 1
Trypanosoma brucei 6-phosphofructo-2-kinase 2 0.0443 0.9826 0.9826
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0137 0.0137
Schistosoma mansoni hypothetical protein 0.0036 0.052 0.0466
Echinococcus granulosus dna polymerase eta 0.0045 0.0722 0.0669
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0137 0.0081
Schistosoma mansoni hypothetical protein 0.017 0.3583 0.3546
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0273 0.6006
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0744 0.0692
Loa Loa (eye worm) MH2 domain-containing protein 0.012 0.2434 0.2391
Plasmodium vivax flap endonuclease 1, putative 0.0026 0.0292 1
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0137 0.0137
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0057 0.0001
Schistosoma mansoni 6-phosphofructokinase 0.0451 1 1
Schistosoma mansoni DNA polymerase eta 0.0045 0.0722 0.0669
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0838 0.0786
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0744 0.0692
Brugia malayi hypothetical protein 0.0036 0.052 0.195
Brugia malayi Flap endonuclease-1 0.0026 0.0292 0.0991
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0137 0.0137
Brugia malayi ImpB/MucB/SamB family protein 0.0045 0.0722 0.2799
Leishmania major DNA polymerase eta, putative 0.0032 0.0417 0.0361
Echinococcus granulosus flap endonuclease 1 0.0026 0.0292 0.0237
Trypanosoma brucei 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative 0.0451 1 1

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) ND 0 % Antiallergic activity against passive cutaneous anaphylaxis (PCA) in male Sprague-Dawley rats (10 mg/kg oral administration) ChEMBL. 6137568
Inhibition (functional) = 29 % Inhibition of passive cutaneous anaphylaxis in male Sprague-Dawley rats following 0.3 mg/kg p.o. administration; Not significant. ChEMBL. 6137568
Inhibition (functional) = 71 % Inhibition of passive cutaneous anaphylaxis in male Sprague-Dawley rats following 1 mg/kg p.o. administration; Not significant. ChEMBL. 6137568
Inhibition (functional) = 83 % Antiallergic activity against passive cutaneous anaphylaxis(PCA) in male Sprague-Dawley rats after 3.0 mg/kg oral administration;not statistically significant ChEMBL. 6137568

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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