Detailed information for compound 569731

Basic information

Technical information
  • TDR Targets ID: 569731
  • Name: sodium (3-acetamido-4-hydroxy-phenyl)-hydroxy -arsinate
  • MW: 298.08 | Formula: C8H10AsNNaO5
  • H donors: 3 H acceptors: 5 LogP: -0.99 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)Nc1cc(ccc1O)[As](=O)(O)[O-].[NaH+]
  • InChi: 1S/C8H10AsNO5.Na/c1-5(11)10-7-4-6(9(13,14)15)2-3-8(7)12;/h2-4,12H,1H3,(H,10,11)(H2,13,14,15);/q;+1/p-1
  • InChiKey: UYQUMYMLNDDPIP-UHFFFAOYSA-M  

Network

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Synonyms

  • sodium (3-acetamido-4-hydroxyphenyl)-hydroxyarsinate
  • acetarsol
  • sodium 2-acetamido-4-arsonophenolate
  • sodium 2-acetamido-4-arsono-phenolate
  • 5892-48-8
  • 55588-51-7
  • 97-44-9
  • Arsonic acid, (3-(acetylamino)-4-hydroxyphenyl)-, monosodium salt (9CI)
  • EINECS 227-573-1
  • Sodium N-acetyl-4-hydroxy-m-arsanilate
  • Sodium acetarsone
  • Sodium hydrogen (3-acetamido-4-hydroxyphenyl)arsonate
  • m-ARSANILIC ACID, N-ACETYL-4-HYDROXY-, SODIUM SALT
  • Acetarsol sodium
  • EINECS 259-714-8
  • Acetarsol natrium

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
Echinococcus granulosus inositol monophosphatase 1 0.0037 0.1095 0.098
Schistosoma mansoni inositol monophosphatase 0.0037 0.1095 0.1095
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0961 0.0961
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.2614 1
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.1095 0.5
Brugia malayi hypothetical protein 0.0035 0.0961 0.2
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.2614 0.2614
Trichomonas vaginalis inositol monophosphatase, putative 0.0037 0.1095 0.5
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.2614 1
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.2614 1
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.2614 0.2518
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.1095 0.5
Schistosoma mansoni bromodomain containing protein 0.0063 0.2866 0.2866
Schistosoma mansoni hypothetical protein 0.017 1 1
Loa Loa (eye worm) hypothetical protein 0.0038 0.1192 0.3541
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0036 0.1028 0.0911
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.1095 0.5
Echinococcus multilocularis inositol monophosphatase 1 0.0037 0.1095 0.098
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0961 0.0843
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.2614 1
Brugia malayi Bromodomain containing protein 0.0075 0.3653 1
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.2614 0.2518
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0036 0.1028 0.0911
Loa Loa (eye worm) hypothetical protein 0.0041 0.1351 0.4014
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0037 0.1095 0.5
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.2614 1
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0033 0.0835 0.5
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0037 0.1095 0.5
Brugia malayi Bromodomain containing protein 0.0038 0.1187 0.2673
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.006 0.2625 0.2529
Schistosoma mansoni hypothetical protein 0.0035 0.0961 0.0961
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.006 0.2625 0.2529
Schistosoma mansoni inositol monophosphatase 0.0037 0.1095 0.1095
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0128 0.0128
Echinococcus multilocularis geminin 0.017 1 1
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.2614 0.2614
Loa Loa (eye worm) hypothetical protein 0.0043 0.1479 0.4395
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.2614 1
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0037 0.1095 0.5
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0037 0.1095 1
Schistosoma mansoni hypothetical protein 0.017 1 1
Loa Loa (eye worm) inositol-1 0.0037 0.1095 0.3255
Brugia malayi Inositol-1 0.0037 0.1095 0.2401
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0961 0.0843
Loa Loa (eye worm) hypothetical protein 0.0071 0.3366 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.
 
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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