Detailed information for compound 1466646

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 371.344 | Formula: C18H17N3O6
  • H donors: 2 H acceptors: 3 LogP: 2.17 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1O)c1nnc([nH]1)c1cc(OC)c2c(c1OC)OCO2
  • InChi: 1S/C18H17N3O6/c1-23-12-5-4-9(6-11(12)22)17-19-18(21-20-17)10-7-13(24-2)15-16(14(10)25-3)27-8-26-15/h4-7,22H,8H2,1-3H3,(H,19,20,21)
  • InChiKey: YPDKEICMYFAYCN-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

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 serine:threonine protein kinase PLK1 0.0096 0.0093 0.2446
Schistosoma mansoni kinase 0.0049 0.0022 0.0587
Brugia malayi UDP-N-acetylglucosamine-dolichyl-phosphate N-acetylglucosaminephosphotransferase 0.0279 0.037 1
Plasmodium falciparum UDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0279 0.037 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0024 0.0651
Trichomonas vaginalis CAMK family protein kinase 0.0096 0.0093 0.2081
Mycobacterium ulcerans phospho-N-acetylmuramoyl-pentapeptide-transferase 0.6657 1 1
Entamoeba histolytica serine/threonine protein kinase, putative 0.0096 0.0093 0.2446
Onchocerca volvulus 0.0153 0.0179 0.4622
Schistosoma mansoni serine/threonine protein kinase 0.0096 0.0093 0.2505
Trichomonas vaginalis CAMK family protein kinase 0.0096 0.0093 0.2081
Wolbachia endosymbiont of Brugia malayi phospho-N-acetylmuramoyl-pentapeptide-transferase 0.6657 1 0.5
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0003 0.0078
Trichomonas vaginalis CAMK family protein kinase 0.0096 0.0093 0.2081
Trypanosoma cruzi UDP-N-acetylglucosamine-dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0279 0.037 1
Schistosoma mansoni hypothetical protein 0.0036 0.0003 0.0078
Brugia malayi hypothetical protein 0.0153 0.0179 0.4832
Trichomonas vaginalis glucosaminephosphotransferase, putative 0.0279 0.037 1
Brugia malayi serine/threonine-protein kinase plk-2 0.0096 0.0093 0.2505
Loa Loa (eye worm) CAMK/CAMKL/PASK protein kinase 0.0044 0.0014 0.0391
Treponema pallidum phospho-N-acetylmuramoyl-pentapeptide-transferase (mraY) 0.253 0.3769 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0024 0.0651
Trichomonas vaginalis CAMK family protein kinase 0.0096 0.0093 0.2081
Toxoplasma gondii glycosyl transferase, group 4 family protein 0.0279 0.037 0.5
Onchocerca volvulus 0.0279 0.037 1
Loa Loa (eye worm) hypothetical protein 0.0279 0.037 1
Plasmodium vivax N-acetylglucosamine-1-phosphate transferase, putative 0.0279 0.037 0.5
Entamoeba histolytica UDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0279 0.037 1
Chlamydia trachomatis phospho-N-acetylmuramoyl-pentapeptide-transferase 0.253 0.3769 0.5
Echinococcus granulosus UDP N acetylglucosamine dolichyl phosphate 0.0279 0.037 1
Mycobacterium tuberculosis Probable phospho-N-acetylmuramoyl-pentappeptidetransferase MurX 0.6657 1 0.5
Brugia malayi hypothetical protein 0.0036 0.0003 0.0078
Trichomonas vaginalis CAMK family protein kinase 0.0096 0.0093 0.2081
Echinococcus multilocularis UDP N acetylglucosamine dolichyl phosphate 0.0279 0.037 1
Trichomonas vaginalis CAMK family protein kinase 0.0096 0.0093 0.2081
Schistosoma mansoni UDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferase 0.0279 0.037 1
Trichomonas vaginalis CAMK family protein kinase 0.0096 0.0093 0.2081
Loa Loa (eye worm) hypothetical protein 0.0153 0.0179 0.4832
Schistosoma mansoni UDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferase 0.0279 0.037 1
Leishmania major UDP-N-acetylglucosamine-dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0279 0.037 1
Onchocerca volvulus Serine\/threonine kinase homolog 0.0096 0.0093 0.2201
Trypanosoma cruzi UDP-N-acetylglucosamine-dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0279 0.037 1
Giardia lamblia UDP-N-acetylglucosamine-dolichyl-phosphateN-acetylglucosaminephosphotransferase 0.0279 0.037 1
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0096 0.0093 0.2505
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0024 0.0651
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0096 0.0093 0.2446
Loa Loa (eye worm) hypothetical protein 0.005 0.0024 0.0651
Trypanosoma brucei UDP-N-acetylglucosamine-dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0279 0.037 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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