Detailed information for compound 557859

Basic information

Technical information
  • TDR Targets ID: 557859
  • Name: 4-formyl-2-nitro-phenolate
  • MW: 166.111 | Formula: C7H4NO4-
  • H donors: 0 H acceptors: 4 LogP: 1.51 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=Cc1ccc(c(c1)[N+](=O)[O-])[O-]
  • InChi: 1S/C7H5NO4/c9-4-5-1-2-7(10)6(3-5)8(11)12/h1-4,10H/p-1
  • InChiKey: YTHJCZRFJGXPTL-UHFFFAOYSA-M  


Substructure search Similarity search

Network

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Synonyms

  • 4-formyl-2-nitrophenolate
  • 4-methanoyl-2-nitro-phenolate
  • 4-hydroxy-3-nitrobenzaldehyde
  • ZINC00562702

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) RNA recognition domain-containing protein domain-containing protein 0.0062 0.1687 0.1888
Echinococcus granulosus lysine specific demethylase 5A 0.004 0.0886 0.1625
Loa Loa (eye worm) hypothetical protein 0.0049 0.1208 0.1352
Brugia malayi Trypsin family protein 0.0087 0.2594 0.2594
Loa Loa (eye worm) hypothetical protein 0.0027 0.0411 0.046
Schistosoma mansoni tar DNA-binding protein 0.0062 0.1687 0.3094
Toxoplasma gondii ornithine aminotransferase, mitochondrial precursor, putative 0.0026 0.0381 0.6
Plasmodium falciparum phd finger protein, putative 0.0033 0.0635 1
Mycobacterium ulcerans acetylornithine aminotransferase 0.0026 0.0381 0.0219
Schistosoma mansoni hypothetical protein 0.0167 0.545 1
Echinococcus multilocularis peregrin 0.0033 0.0635 0.1164
Echinococcus multilocularis Aminotransferase class III 0.0026 0.0381 0.0699
Toxoplasma gondii PHD-finger domain-containing protein 0.0033 0.0635 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.1208 0.1352
Schistosoma mansoni hypothetical protein 0.0094 0.2834 0.5199
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.002 0.0166 0.0166
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0109 0.3353 0.6152
Mycobacterium tuberculosis Probable aminotransferase 0.0026 0.0381 0.0381
Loa Loa (eye worm) PHD-finger family protein 0.0033 0.0635 0.071
Schistosoma mansoni cercarial elastase (S01 family) 0.0087 0.2594 0.4759
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0027 0.0411 1
Echinococcus multilocularis Peptidase S1 S6, chymotrypsin Hap 0.0087 0.2594 0.4759
Echinococcus multilocularis PHD finger protein rhinoceros 0.0033 0.0635 0.1164
Mycobacterium ulcerans glutamate-1-semialdehyde aminotransferase 0.0026 0.0381 0.0219
Loa Loa (eye worm) hypothetical protein 0.0087 0.2594 0.2904
Echinococcus granulosus geminin 0.0167 0.545 1
Schistosoma mansoni hypothetical protein 0.0094 0.2834 0.5199
Brugia malayi RNA recognition motif domain containing protein 0.0062 0.1687 0.1687
Brugia malayi AMP-binding enzyme family protein 0.0027 0.0411 0.0411
Entamoeba histolytica hypothetical protein 0.0035 0.0716 1
Loa Loa (eye worm) transcription factor SMAD2 0.0117 0.3674 0.4113
Brugia malayi jmjC domain containing protein 0.004 0.0886 0.0886
Mycobacterium ulcerans ornithine aminotransferase RocD1 and RocD2 0.0026 0.0381 0.0219
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0019 0.0126 0.0126
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0087 0.2594 0.4759
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0087 0.2594 0.4759
Leishmania major 4-coumarate:coa ligase-like protein 0.0027 0.0411 1
Loa Loa (eye worm) hypothetical protein 0.0087 0.2594 0.2904
Loa Loa (eye worm) hypothetical protein 0.0087 0.2594 0.2904
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0019 0.0126 0.0126
Echinococcus multilocularis geminin 0.0167 0.545 1
Mycobacterium ulcerans 4-aminobutyrate aminotransferase 0.0026 0.0381 0.0219
Mycobacterium ulcerans adenosylmethionine-8-amino-7-oxononanoate aminotransferase 0.0026 0.0381 0.0219
Entamoeba histolytica hypothetical protein 0.0035 0.0716 1
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0094 0.2834 0.2834
Schistosoma mansoni cercarial elastase (S01 family) 0.0087 0.2594 0.4759
Mycobacterium ulcerans 4-aminobutyrate aminotransferase 0.0026 0.0381 0.0219
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0087 0.2594 0.4759
Loa Loa (eye worm) hypothetical protein 0.002 0.0166 0.0185
Echinococcus multilocularis tar DNA binding protein 0.0062 0.1687 0.3094
Onchocerca volvulus 0.0087 0.2594 0.2885
Schistosoma mansoni apoptosis regulator bax 0.0094 0.2834 0.5199
Loa Loa (eye worm) hypothetical protein 0.0094 0.2834 0.3172
Schistosoma mansoni cercarial elastase (S01 family) 0.0087 0.2594 0.4759
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0716 0.1313
Echinococcus multilocularis jumonji domain containing protein 0.0046 0.1103 0.2023
Loa Loa (eye worm) hypothetical protein 0.0087 0.2594 0.2904
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0087 0.2594 0.4759
Loa Loa (eye worm) hypothetical protein 0.002 0.0166 0.0185
Brugia malayi Trypsin family protein 0.0087 0.2594 0.2594
Brugia malayi jmjC domain containing protein 0.0109 0.3353 0.3353
Mycobacterium ulcerans acyl-CoA synthetase 0.0027 0.0411 0.025
Onchocerca volvulus Alhambra homolog 0.0033 0.0635 0.0295
Leishmania major hypothetical protein, conserved 0.0025 0.0334 0.8113
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0027 0.0411 0.025
Onchocerca volvulus 0.0087 0.2594 0.2885
Echinococcus granulosus peregrin 0.0033 0.0635 0.1164
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0716 0.1313
Onchocerca volvulus 0.0087 0.2594 0.2885
Loa Loa (eye worm) jmjC domain-containing protein 0.004 0.0886 0.0992
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0716 0.1313
Loa Loa (eye worm) hypothetical protein 0.0027 0.0411 0.046
Echinococcus granulosus Peptidase S1 S6 chymotrypsin Hap 0.0087 0.2594 0.4759
Echinococcus granulosus PHD finger protein rhinoceros 0.0033 0.0635 0.1164
Echinococcus multilocularis lysine specific demethylase 5A 0.004 0.0886 0.1625
Brugia malayi AMP-binding enzyme family protein 0.0027 0.0411 0.0411
Schistosoma mansoni hypothetical protein 0.0033 0.0635 0.1164
Plasmodium vivax hypothetical protein, conserved 0.0033 0.0635 1
Entamoeba histolytica hypothetical protein 0.0035 0.0716 1
Loa Loa (eye worm) hypothetical protein 0.0087 0.2594 0.2904
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0648 0.0648
Plasmodium vivax ornithine aminotransferase, putative 0.0026 0.0381 0.6
Mycobacterium tuberculosis Probable L-lysine-epsilon aminotransferase Lat (L-lysine aminotransferase) (lysine 6-aminotransferase) 0.0293 1 1
Mycobacterium ulcerans hypothetical protein 0.0087 0.2594 0.2469
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0027 0.0411 0.025
Echinococcus granulosus tar DNA binding protein 0.0062 0.1687 0.3094
Brugia malayi AMP-binding enzyme family protein 0.0027 0.0411 0.0411
Mycobacterium ulcerans hypothetical protein 0.0026 0.0381 0.0219
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0094 0.2834 0.5199
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0334 0.5259
Schistosoma mansoni jumonji domain containing protein 0.0086 0.2549 0.4677
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.1208 0.1208
Plasmodium vivax acyl-CoA synthetase, putative 0.002 0.0166 0.2611
Brugia malayi Pax transcription factor protein 2 0.0237 0.7977 0.7977
Entamoeba histolytica hypothetical protein 0.0035 0.0716 1
Echinococcus multilocularis enteropeptidase 0.0087 0.2594 0.4759
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0087 0.2594 0.4759
Schistosoma mansoni tar DNA-binding protein 0.0062 0.1687 0.3094
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0263 0.8933 1
Echinococcus multilocularis glycoprotein Antigen 5 0.0087 0.2594 0.4759
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0027 0.0411 0.0411
Mycobacterium tuberculosis Probable glutamate-1-semialdehyde 2,1-aminomutase HemL (GSA) (glutamate-1-semialdehyde aminotransferase) (GSA-at) 0.0026 0.0381 0.0381
Brugia malayi follicle stimulating hormone receptor 0.0263 0.8933 0.8933
Schistosoma mansoni hypothetical protein 0.0167 0.545 1
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0094 0.2834 0.5199
Echinococcus multilocularis transmembrane protease serine 3 0.0087 0.2594 0.4759
Echinococcus granulosus jumonji domain containing protein 0.0046 0.1103 0.2023
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0334 1
Echinococcus granulosus ornithine aminotransferase 0.0026 0.0381 0.0699
Schistosoma mansoni tar DNA-binding protein 0.0062 0.1687 0.3094
Echinococcus multilocularis ornithine aminotransferase 0.0026 0.0381 0.0699
Schistosoma mansoni cercarial elastase (S01 family) 0.0087 0.2594 0.4759
Schistosoma mansoni hypothetical protein 0.0035 0.0716 0.1313
Mycobacterium ulcerans acyl-CoA synthetase 0.0027 0.0411 0.025
Brugia malayi Bromodomain containing protein 0.0033 0.0635 0.0635
Loa Loa (eye worm) jmjC domain-containing protein 0.0068 0.1907 0.2135
Loa Loa (eye worm) hypothetical protein 0.0033 0.0635 0.071
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0027 0.0411 0.025
Schistosoma mansoni cercarial elastase (S01 family) 0.0087 0.2594 0.4759
Loa Loa (eye worm) hypothetical protein 0.0087 0.2594 0.2904
Echinococcus granulosus Aminotransferase class III 0.0026 0.0381 0.0699
Brugia malayi Trypsin family protein 0.0087 0.2594 0.2594
Brugia malayi hypothetical protein 0.0025 0.0334 0.0334
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0334 1
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0094 0.2834 0.5199
Schistosoma mansoni hypothetical protein 0.0094 0.2834 0.5199
Echinococcus granulosus glycoprotein Antigen 5 0.0087 0.2594 0.4759
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0019 0.0126 0.0126
Leishmania major 4-coumarate:coa ligase-like protein 0.0027 0.0411 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0027 0.0411 1
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0334 0.5259
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0087 0.2594 0.4759
Brugia malayi PHD-finger family protein 0.0033 0.0635 0.0635
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0019 0.0126 0.0126
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0027 0.0411 0.0411
Loa Loa (eye worm) TAR-binding protein 0.0062 0.1687 0.1888
Schistosoma mansoni hypothetical protein 0.0087 0.2594 0.4759
Mycobacterium ulcerans hypothetical protein 0.0027 0.0411 0.025
Schistosoma mansoni ornithine--oxo-acid transaminase 0.0026 0.0381 0.0699
Mycobacterium ulcerans L-lysine aminotransferase 0.0293 1 1
Echinococcus granulosus Mastin 0.0087 0.2594 0.4759
Brugia malayi hypothetical protein 0.0016 0.0017 0.0017
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0033 0.0635 0.1164
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0087 0.2594 0.4759
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0087 0.2594 0.4759
Loa Loa (eye worm) RNA binding protein 0.0062 0.1687 0.1888
Loa Loa (eye worm) apoptosis regulator protein 0.0094 0.2834 0.3172
Echinococcus multilocularis ornithine aminotransferase 0.0026 0.0381 0.0699
Loa Loa (eye worm) MH2 domain-containing protein 0.0117 0.3674 0.4113
Loa Loa (eye worm) hypothetical protein 0.0027 0.0411 0.046
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0027 0.0411 1
Echinococcus granulosus transmembrane protease serine 3 0.0087 0.2594 0.4759
Plasmodium falciparum acyl-CoA synthetase 0.002 0.0166 0.2611
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0334 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0334 0.5259
Schistosoma mansoni cercarial elastase (S01 family) 0.0087 0.2594 0.4759
Loa Loa (eye worm) hypothetical protein 0.0034 0.0648 0.0726
Loa Loa (eye worm) trypsin family protein 0.0087 0.2594 0.2904
Onchocerca volvulus 0.0237 0.7977 1
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0027 0.0411 0.025
Brugia malayi Trypsin family protein 0.0087 0.2594 0.2594
Brugia malayi RNA binding protein 0.0062 0.1687 0.1687
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0109 0.3353 0.6152
Echinococcus granulosus enteropeptidase 0.0087 0.2594 0.4759
Loa Loa (eye worm) hypothetical protein 0.0087 0.2594 0.2904
Brugia malayi hypothetical protein 0.0087 0.2594 0.2594
Wolbachia endosymbiont of Brugia malayi acetylornithine transaminase protein 0.0026 0.0381 0.5
Loa Loa (eye worm) hypothetical protein 0.002 0.0166 0.0185
Echinococcus granulosus subfamily S1A unassigned peptidase S01 family 0.0087 0.2594 0.4759
Schistosoma mansoni cercarial elastase (S01 family) 0.0087 0.2594 0.4759
Schistosoma mansoni cercarial elastase (S01 family) 0.0087 0.2594 0.4759
Schistosoma mansoni jumonji/arid domain-containing protein 0.004 0.0886 0.1625
Loa Loa (eye worm) hypothetical protein 0.0057 0.1488 0.1666
Echinococcus multilocularis Mastin 0.0087 0.2594 0.4759
Brugia malayi Trypsin-like protease protein 5 0.0087 0.2594 0.2594
Schistosoma mansoni tar DNA-binding protein 0.0062 0.1687 0.3094
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0094 0.2834 0.5199
Schistosoma mansoni hypothetical protein 0.0034 0.0648 0.119
Loa Loa (eye worm) hypothetical protein 0.002 0.0166 0.0185
Onchocerca volvulus 0.0087 0.2594 0.2885
Brugia malayi TAR-binding protein 0.0062 0.1687 0.1687
Loa Loa (eye worm) hypothetical protein 0.0025 0.0334 0.0374
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0334 0.5259
Schistosoma mansoni cercarial elastase (S01 family) 0.0087 0.2594 0.4759
Echinococcus multilocularis subfamily S1A unassigned peptidase (S01 family) 0.0087 0.2594 0.4759
Giardia lamblia PHD finger protein 15 0.0033 0.0635 0.5
Brugia malayi MH2 domain containing protein 0.0117 0.3674 0.3674
Loa Loa (eye worm) hypothetical protein 0.002 0.0166 0.0185
Onchocerca volvulus 0.0087 0.2594 0.2885
Schistosoma mansoni jumonji/arid domain-containing protein 0.004 0.0886 0.1625
Schistosoma mansoni tar DNA-binding protein 0.0062 0.1687 0.3094
Mycobacterium tuberculosis Probable ornithine aminotransferase (N-terminus part) RocD1 (ornithine--oxo-acid aminotransferase) 0.0026 0.0381 0.0381
Brugia malayi hypothetical protein 0.0035 0.0716 0.0716
Toxoplasma gondii PHD-finger domain-containing protein 0.0033 0.0635 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0087 0.2594 0.4759
Loa Loa (eye worm) pax transcription factor protein 2 0.0237 0.7977 0.893
Mycobacterium tuberculosis Adenosylmethionine-8-amino-7-oxononanoate aminotransferase BioA 0.0026 0.0381 0.0381
Plasmodium falciparum ornithine aminotransferase 0.0026 0.0381 0.6
Onchocerca volvulus 0.0087 0.2594 0.2885
Mycobacterium tuberculosis Probable acetylornithine aminotransferase ArgD 0.0026 0.0381 0.0381
Brugia malayi Chymotrypsin-like protease CTRL-1 precursor 0.0087 0.2594 0.2594
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0094 0.2834 0.5199
Trichomonas vaginalis acetylornithine aminotransferase, putative 0.0026 0.0381 0.5
Schistosoma mansoni cercarial elastase (S01 family) 0.0087 0.2594 0.4759
Schistosoma mansoni hypothetical protein 0.0087 0.2594 0.4759
Mycobacterium ulcerans acyl-CoA synthetase 0.0027 0.0411 0.025
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.1208 0.1208
Chlamydia trachomatis glutamate-1-semialdehyde-2,1-aminomutase 0.0026 0.0381 1

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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