Detailed information for compound 539925

Basic information

Technical information
  • TDR Targets ID: 539925
  • Name: (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(difluo romethyl)tetrahydrofuran-3,4-diol
  • MW: 287.223 | Formula: C10H11F2N5O3
  • H donors: 3 H acceptors: 5 LogP: -0.92 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: FC([C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)F
  • InChi: 1S/C10H11F2N5O3/c11-7(12)6-4(18)5(19)10(20-6)17-2-16-3-8(13)14-1-15-9(3)17/h1-2,4-7,10,18-19H,(H2,13,14,15)/t4-,5+,6-,10+/m0/s1
  • InChiKey: YQLJSFYLQCBEKY-LKCKTBJASA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(difluoromethyl)oxolane-3,4-diol
  • (2R,3R,4S,5S)-2-adenin-9-yl-5-(difluoromethyl)tetrahydrofuran-3,4-diol
  • 5'-deoxy-5'-difluoroadenosine
  • (2R,3R,4S,5S)-2-(6-amino-9-purinyl)-5-(difluoromethyl)tetrahydrofuran-3,4-diol
  • 131077-98-0
  • 5-Ddfa
  • Adenosine, 5'-deoxy-5',5'-difluoro-

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
Trichomonas vaginalis ferritin, putative 0.0018 0.0042 0.0042
Brugia malayi hypothetical protein 0.0038 0.0706 0.0706
Mycobacterium tuberculosis Conserved hypothetical protein 0.0159 0.4796 0.4775
Entamoeba histolytica adenosylhomocysteinase, putative 0.0312 1 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0038 0.0706 0.0706
Schistosoma mansoni adenosylhomocysteinase 0.0312 1 1
Mycobacterium ulcerans hypothetical protein 0.0159 0.4796 0.4775
Echinococcus granulosus lamin 0.0057 0.1368 0.1368
Schistosoma mansoni apoferritin-2 0.0018 0.0042 0.0042
Entamoeba histolytica hypothetical protein 0.0038 0.0706 0.0706
Loa Loa (eye worm) hypothetical protein 0.0057 0.1368 0.1368
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1626 0.0842
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0042 0.0856 0.0856
Echinococcus multilocularis adenosylhomocysteinase 0.0312 1 1
Schistosoma mansoni adenosylhomocysteinase 0.0193 0.5968 0.5968
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0028 0.0361 0.0361
Echinococcus multilocularis lamin 0.0057 0.1368 0.1368
Echinococcus granulosus expressed protein 0.0018 0.0042 0.0042
Schistosoma mansoni lamin 0.0057 0.1368 0.1368
Plasmodium vivax adenosylhomocysteinase(S-adenosyl-L-homocystein e hydrolase), putative 0.0312 1 1
Echinococcus granulosus adenosylhomocysteinase 0.0312 1 1
Schistosoma mansoni adenosylhomocysteinase 0.0193 0.5968 0.5968
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0042 0.0856 0.0856
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0143 0.4251 0.3713
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1626 0.0842
Onchocerca volvulus 0.0057 0.1368 1
Mycobacterium ulcerans S-adenosyl-L-homocysteine hydrolase 0.0312 1 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0361 0.0361
Brugia malayi cytoplasmic intermediate filament protein 0.0031 0.0464 0.0464
Trichomonas vaginalis adenosylhomocysteinase, putative 0.0098 0.2742 0.2742
Leishmania major cathepsin L-like protease 0.0065 0.1626 0.1626
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0031 0.0464 0.0464
Schistosoma mansoni ferritin light chain 0.0018 0.0042 0.0042
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1626 0.0842
Trypanosoma brucei S-adenosylhomocysteine hydrolase, putative 0.0312 1 1
Echinococcus multilocularis expressed protein 0.0018 0.0042 0.0042
Trypanosoma cruzi cysteine peptidase, putative 0.0065 0.1626 0.1626
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1626 0.0842
Schistosoma mansoni adenosylhomocysteinase 0.0193 0.5968 0.5968
Brugia malayi intermediate filament protein 0.0057 0.1368 0.1368
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1626 0.0842
Mycobacterium leprae putative S-adenosyl-L-homocysteine hydrolase SahH 0.0312 1 1
Schistosoma mansoni ferritin 0.0018 0.0042 0.0042
Trypanosoma cruzi S-adenosylhomocysteine hydrolase, putative 0.0312 1 1
Schistosoma mansoni ferritin 0.0018 0.0042 0.0042
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0059 0.1435 0.1435
Echinococcus multilocularis musashi 0.0057 0.1368 0.1368
Plasmodium falciparum adenosylhomocysteinase 0.0312 1 1
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0301 0.9626 0.9591
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0042 0.0856 0.0856
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1626 0.0842
Schistosoma mansoni apoferritin-2 0.0018 0.0042 0.0042
Schistosoma mansoni transcription factor LCR-F1 0.0038 0.0706 0.0706
Echinococcus granulosus lamin dm0 0.0057 0.1368 0.1368
Trichomonas vaginalis adenosylhomocysteinase, putative 0.0312 1 1
Schistosoma mansoni lamin 0.0057 0.1368 0.1368
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0038 0.0706 0.0706
Trypanosoma cruzi cysteine peptidase, putative 0.0065 0.1626 0.1626
Echinococcus granulosus intermediate filament protein 0.0057 0.1368 0.1368
Treponema pallidum bacterioferrin (TpF1) 0.0018 0.0042 0.5
Schistosoma mansoni hypothetical protein 0.0038 0.0706 0.0706
Entamoeba histolytica hypothetical protein 0.0038 0.0706 0.0706
Schistosoma mansoni intermediate filament proteins 0.0057 0.1368 0.1368
Trichomonas vaginalis adenosylhomocysteinase, putative 0.0312 1 1
Schistosoma mansoni adenosylhomocysteinase 0.0193 0.5968 0.5968
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1626 0.0842
Loa Loa (eye worm) hypothetical protein 0.0056 0.1333 0.1333
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1626 0.0842
Echinococcus granulosus ferritin 0.0018 0.0042 0.0042
Onchocerca volvulus 0.0057 0.1368 1
Leishmania major cathepsin L-like protease 0.0065 0.1626 0.1626
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0143 0.4251 0.4251
Loa Loa (eye worm) adenosylhomocysteinase 0.0312 1 1
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0301 0.9626 0.9626
Brugia malayi MH2 domain containing protein 0.0238 0.7468 0.7468
Toxoplasma gondii adenosylhomocysteinase, putative 0.0312 1 1
Loa Loa (eye worm) transcription factor SMAD2 0.0238 0.7468 0.7468
Echinococcus multilocularis lamin dm0 0.0057 0.1368 0.1368
Trypanosoma cruzi cysteine peptidase, putative 0.0065 0.1626 0.1626
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0028 0.0361 0.0361
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1626 0.0842
Trypanosoma cruzi S-adenosylhomocysteine hydrolase, putative 0.0312 1 1
Trypanosoma cruzi cruzipain precursor, putative 0.0065 0.1626 0.1626
Mycobacterium tuberculosis Probable adenosylhomocysteinase SahH (S-adenosyl-L-homocysteine hydrolase) (adohcyase) 0.0312 1 1
Leishmania major cathepsin L-like protease 0.0065 0.1626 0.1626
Trypanosoma cruzi major cysteine proteinase, putative 0.0051 0.1154 0.1154
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1626 0.0842
Schistosoma mansoni ferritin light chain 0.0018 0.0042 0.0042
Entamoeba histolytica hypothetical protein 0.0038 0.0706 0.0706
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0301 0.9626 0.9626
Loa Loa (eye worm) intermediate filament protein 0.0057 0.1368 0.1368
Loa Loa (eye worm) hypothetical protein 0.0027 0.0325 0.0325
Loa Loa (eye worm) MH2 domain-containing protein 0.0238 0.7468 0.7468
Schistosoma mansoni ferritin 0.0018 0.0042 0.0042
Entamoeba histolytica hypothetical protein 0.0038 0.0706 0.0706
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0143 0.4251 0.4251
Toxoplasma gondii hypothetical protein 0.0049 0.1067 0.1067
Wolbachia endosymbiont of Brugia malayi bacterioferritin/cytochrome b1 0.0018 0.0042 0.5
Leishmania major mitochondrial DNA polymerase beta 0.0301 0.9626 0.9626
Echinococcus multilocularis ferritin 0.0018 0.0042 0.0042
Brugia malayi Intermediate filament tail domain containing protein 0.0057 0.1368 0.1368
Loa Loa (eye worm) hypothetical protein 0.0027 0.0325 0.0325
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0052 0.117 0.117
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1626 0.0842
Leishmania major S-adenosylhomocysteine hydrolase 0.0312 1 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0057 0.1368 0.1368
Toxoplasma gondii S-Adenosyl homocysteine hydrolase 0.0312 1 1
Schistosoma mansoni ferritin 0.0018 0.0042 0.0042

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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