Detailed information for compound 979166

Basic information

Technical information
  • TDR Targets ID: 979166
  • Name: AIDS004432
  • MW: 307.256 | Formula: C14H13NO7
  • H donors: 5 H acceptors: 5 LogP: -1.15 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: O[C@H]1Cc2c([C@@H]([C@@H]1O)O)[nH]c(=O)c1c2cc2OCOc2c1O
  • InChi: 1S/C14H13NO7/c16-6-1-5-4-2-7-13(22-3-21-7)11(18)8(4)14(20)15-9(5)12(19)10(6)17/h2,6,10,12,16-19H,1,3H2,(H,15,20)/t6-,10+,12-/m0/s1
  • InChiKey: JIMDZZQKKBUKLO-QDWQASTRSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • Isonarciclasine
  • [1,3]Dioxolo[4,5-j]phenanthridin-6(2H)-one, 1,3,4,5-tetrahydro-2,3,4,7-tetrahydroxy-, (2S,3R,4S)-
  • AIDS-004432

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) hypothetical protein 0.0217 0.5405 0.5405
Loa Loa (eye worm) hypothetical protein 0.0267 0.7311 0.7311
Brugia malayi protein kinase C II. 0.0275 0.7647 1
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0152 0.296 0.1096
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0275 0.7647 0.7647
Loa Loa (eye worm) hypothetical protein 0.0331 0.9756 0.9756
Schistosoma mansoni protein kinase C mu 0.0184 0.4157 0.3065
Echinococcus granulosus RNA directed DNA polymerase 0.0152 0.296 0.1096
Trypanosoma brucei rac serine-threonine kinase, putative 0.0075 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0118 0.1637 0.1637
Echinococcus granulosus serine:threonine protein kinase N2 0.0135 0.231 0.0026
Trichomonas vaginalis AGC family protein kinase 0.0075 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0152 0.296 0.296
Onchocerca volvulus 0.0267 0.7311 1
Onchocerca volvulus 0.0182 0.4082 0.431
Echinococcus multilocularis protein kinase c epsilon type 0.0275 0.7647 0.8807
Trichomonas vaginalis AGC family protein kinase 0.0075 0 0.5
Trichomonas vaginalis AGC family protein kinase 0.0075 0 0.5
Echinococcus granulosus protein kinase c epsilon type 0.0275 0.7647 0.8807
Echinococcus multilocularis serine threonine protein kinase 0.023 0.5927 0.5977
Trichomonas vaginalis AGC family protein kinase 0.0075 0 0.5
Loa Loa (eye worm) CAMK/PKD protein kinase 0.012 0.1712 0.1712
Trichomonas vaginalis AGC family protein kinase 0.0075 0 0.5
Echinococcus multilocularis serine:threonine protein kinase N2 0.0204 0.4925 0.4328
Loa Loa (eye worm) hypothetical protein 0.0267 0.7311 0.7311
Loa Loa (eye worm) hypothetical protein 0.0267 0.7311 0.7311
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0295 0.8372 1
Echinococcus granulosus Protein kinase C brain isozyme 0.0295 0.8372 1
Brugia malayi Phorbol esters/diacylglycerol binding domain 0.0184 0.4157 0.5436
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.0162 0.3312 0.3312
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0184 0.4157 0.4157
Echinococcus multilocularis RNA directed DNA polymerase 0.0152 0.296 0.1096
Schistosoma mansoni serine/threonine protein kinase 0.0295 0.8372 1
Trichomonas vaginalis AGC family protein kinase 0.0075 0 0.5
Schistosoma mansoni serine/threonine protein kinase 0.0275 0.7647 0.8807
Trichomonas vaginalis AGC family protein kinase 0.0075 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0182 0.4082 0.4082
Loa Loa (eye worm) hypothetical protein 0.0118 0.1637 0.1637
Echinococcus granulosus protein kinase C gamma type 0.023 0.5927 0.5977
Schistosoma mansoni serine/threonine protein kinase 0.0295 0.8372 1
Loa Loa (eye worm) hypothetical protein 0.0186 0.4233 0.4233
Brugia malayi C1-like domain containing protein 0.0184 0.4157 0.5436
Trichomonas vaginalis AGC family protein kinase 0.0075 0 0.5
Brugia malayi Protein kinase c protein 2 0.0226 0.5757 0.7529
Entamoeba histolytica PH domain containing protein kinase, putative 0.0139 0.2461 1
Onchocerca volvulus 0.0186 0.4233 0.4576

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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