Detailed information for compound 581474

Basic information

Technical information
  • TDR Targets ID: 581474
  • Name: (2R,3S,4R,5R)-6-arsonooxy-2,3,4,5-tetrahydrox y-hexanoic acid
  • MW: 320.083 | Formula: C6H13AsO10
  • H donors: 7 H acceptors: 9 LogP: -4.35 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 2
  • SMILES: O[C@@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)CO[As](=O)(O)O
  • InChi: 1S/C6H13AsO10/c8-2(1-17-7(14,15)16)3(9)4(10)5(11)6(12)13/h2-5,8-11H,1H2,(H,12,13)(H2,14,15,16)/t2-,3-,4+,5-/m1/s1
  • InChiKey: UYGJCERUUNNTIQ-SQOUGZDYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • (2R,3S,4R,5R)-6-arsonooxy-2,3,4,5-tetrahydroxyhexanoic acid
  • 6-arsenogluconate
  • 76030-89-2
  • D-Gluconic acid, 6-ester with arsenic acid (H3AsO4)

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
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.3245 0.3245
Mycobacterium leprae PROBABLE BACTERIOFERRITIN BFRA 0.0008 0 0.5
Trichomonas vaginalis ferritin, putative 0.0008 0 0.5
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0453 0.0453
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.3245 0.3245
Schistosoma mansoni hypothetical protein 0.0016 0.0453 0.0453
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.257 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.3245 1
Schistosoma mansoni hypothetical protein 0.0016 0.0453 0.0453
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0453 0.0453
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.3245 0.3245
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.257 1
Schistosoma mansoni hypothetical protein 0.0034 0.159 0.159
Schistosoma mansoni hypothetical protein 0.0016 0.0453 0.0453
Schistosoma mansoni hypothetical protein 0.0016 0.0453 0.0453
Echinococcus multilocularis geminin 0.0167 1 1
Echinococcus granulosus GPCR family 2 0.0016 0.0453 0.0453
Loa Loa (eye worm) hypothetical protein 0.0034 0.159 0.5371
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.159 0.5371
Schistosoma mansoni hypothetical protein 0.0167 1 1
Treponema pallidum bacterioferrin (TpF1) 0.0008 0 0.5
Echinococcus multilocularis GPCR, family 2 0.0016 0.0453 0.0453
Plasmodium vivax cyclin dependent kinase 7 (cdk7), putative 0.0116 0.6793 0.5
Wolbachia endosymbiont of Brugia malayi bacterioferritin/cytochrome b1 0.0008 0 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.257 1
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.3245 0.3245
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0453 0.0453
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.3245 1
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.3245 1
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.3245 0.5
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0453 0.0453
Loa Loa (eye worm) hypothetical protein 0.0049 0.257 1
Plasmodium falciparum MO15-related protein kinase 0.0116 0.6793 0.5
Toxoplasma gondii cell-cycle-associated protein kinase, putative 0.0108 0.6311 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.3245 1
Schistosoma mansoni hypothetical protein 0.0167 1 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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