Detailed information for compound 1541592

Basic information

Technical information
  • TDR Targets ID: 1541592
  • Name: 2-(4-Tetrazol-1-yl-phenoxy)-propionic acid
  • MW: 234.211 | Formula: C10H10N4O3
  • H donors: 1 H acceptors: 5 LogP: 1.19 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)C(Oc1ccc(cc1)n1cnnn1)C
  • InChi: 1S/C10H10N4O3/c1-7(10(15)16)17-9-4-2-8(3-5-9)14-6-11-12-13-14/h2-7H,1H3,(H,15,16)
  • InChiKey: LQXQKXFJECQNIC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • SMR000278217
  • ZERO/006369
  • MLS000716700
  • BAS 13521543

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 Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0413 1
Brugia malayi Pax transcription factor protein 2 0.0233 0.6931 1
Schistosoma mansoni ornithine--oxo-acid transaminase 0.0046 0.0387 0.9362
Mycobacterium tuberculosis Probable aminotransferase 0.0321 1 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0413 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0413 1
Loa Loa (eye worm) pax transcription factor protein 2 0.0233 0.6931 1
Mycobacterium tuberculosis Adenosylmethionine-8-amino-7-oxononanoate aminotransferase BioA 0.0321 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0413 0.0596
Mycobacterium ulcerans adenosylmethionine-8-amino-7-oxononanoate aminotransferase 0.0321 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0413 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0413 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.0558 0.0806
Plasmodium vivax ornithine aminotransferase, putative 0.0046 0.0387 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0413 1
Onchocerca volvulus 0.0233 0.6931 0.5
Wolbachia endosymbiont of Brugia malayi acetylornithine transaminase protein 0.0046 0.0387 0.5
Toxoplasma gondii ornithine aminotransferase, mitochondrial precursor, putative 0.0046 0.0387 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.0558 0.0806
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0413 0.0596
Brugia malayi 4-aminobutyrate aminotransferase, mitochondrial precursor 0.0046 0.0387 0.0558
Chlamydia trachomatis glutamate-1-semialdehyde-2,1-aminomutase 0.0046 0.0387 0.5
Loa Loa (eye worm) hypothetical protein 0.0051 0.0558 0.0806
Trichomonas vaginalis acetylornithine aminotransferase, putative 0.0321 1 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0413 1
Plasmodium falciparum ornithine aminotransferase 0.0046 0.0387 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.0558 0.0806
Mycobacterium ulcerans hypothetical protein 0.0321 1 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

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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