Detailed information for compound 583858

Basic information

Technical information
  • TDR Targets ID: 583858
  • Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymet hyl)tetrahydrofuran-2-yl]-8-[(Z)-(1-hydroxy-4 -quinolylidene)amino]-3H-purin-6-one
  • MW: 425.398 | Formula: C19H19N7O5
  • H donors: 5 H acceptors: 5 LogP: -0.3 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC[C@H]1O[C@H](C[C@@H]1O)n1c(/N=c\2/ccn(c3c2cccc3)O)nc2c1[nH]c(N)nc2=O
  • InChi: 1S/C19H19N7O5/c20-18-23-16-15(17(29)24-18)22-19(26(16)14-7-12(28)13(8-27)31-14)21-10-5-6-25(30)11-4-2-1-3-9(10)11/h1-6,12-14,27-28,30H,7-8H2,(H3,20,23,24,29)/b21-10-/t12-,13+,14+/m0/s1
  • InChiKey: DARBCSNLQDYNIO-XGAHARMMSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-8-[(Z)-(1-hydroxy-4-quinolylidene)amino]-3H-purin-6-one
  • 2-azanyl-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-8-[(Z)-(1-hydroxyquinolin-4-ylidene)amino]-3H-purin-6-one
  • 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-8-[(Z)-(1-hydroxy-4-quinolylidene)amino]-3H-purin-6-one
  • 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-8-[(Z)-(1-hydroxyquinolin-4-ylidene)amino]-3H-purin-6-one
  • N-(deoxyguanosin-C(8)-yl)-4-aminoquinoline 1-oxide

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) pigment dispersing factor receptor c 0.005 0.0846 0.7319
Schistosoma mansoni tar DNA-binding protein 0.0064 0.1157 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0064 0.0064
Trypanosoma cruzi hypothetical protein, conserved 0.0013 0 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0013 0 0.5
Schistosoma mansoni hypothetical protein 0.0016 0.0064 0.0549
Schistosoma mansoni tar DNA-binding protein 0.0064 0.1157 1
Schistosoma mansoni hypothetical protein 0.0034 0.0484 0.4186
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0013 0 0.5
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0064 0.0549
Schistosoma mansoni tar DNA-binding protein 0.0064 0.1157 1
Leishmania major cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100 0.0013 0 0.5
Echinococcus multilocularis tar DNA binding protein 0.0064 0.1157 0.1157
Trypanosoma cruzi hypothetical protein, conserved 0.0013 0 0.5
Echinococcus granulosus tar DNA binding protein 0.0064 0.1157 0.1157
Leishmania major cAMP-specific phosphodiesterase, putative 0.0013 0 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0013 0 0.5
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0064 0.0549
Loa Loa (eye worm) RNA binding protein 0.0064 0.1157 1
Loa Loa (eye worm) TAR-binding protein 0.0064 0.1157 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0846 0.7319
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0013 0 0.5
Trypanosoma brucei cAMP-specific phosphodiesterase, putative 0.0013 0 0.5
Schistosoma mansoni hypothetical protein 0.0016 0.0064 0.0549
Loa Loa (eye worm) hypothetical protein 0.0016 0.0064 0.0549
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic 0.0454 1 1
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0013 0 0.5
Mycobacterium ulcerans enoyl-(acyl carrier protein) reductase 0.0194 0.4102 0.5
Schistosoma mansoni hypothetical protein 0.0016 0.0064 0.0549
Trypanosoma cruzi hypothetical protein, conserved 0.0013 0 0.5
Trypanosoma cruzi cyclic nucleotide phosphodiesterase 0.0013 0 0.5
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0013 0 0.5
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0013 0 0.5
Schistosoma mansoni tar DNA-binding protein 0.0064 0.1157 1
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0013 0 0.5
Plasmodium falciparum enoyl-acyl carrier reductase 0.0194 0.4102 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0846 0.7319
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.1157 1
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.0013 0 0.5
Leishmania major hypothetical protein, conserved 0.0013 0 0.5
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0013 0 0.5
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.0013 0 0.5
Echinococcus multilocularis GPCR, family 2 0.0016 0.0064 0.0064
Leishmania major hypothetical protein, conserved 0.0013 0 0.5
Echinococcus granulosus GPCR family 2 0.0016 0.0064 0.0064
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.1157 1
Schistosoma mansoni tar DNA-binding protein 0.0064 0.1157 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0484 0.4186
Toxoplasma gondii enoyl-acyl carrier reductase ENR 0.0194 0.4102 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0064 0.0064
Trypanosoma cruzi hypothetical protein, conserved 0.0013 0 0.5
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0064 0.0064
Mycobacterium leprae NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) 0.0194 0.4102 0.5
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0013 0 0.5
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0064 0.0549
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0064 0.0064
Loa Loa (eye worm) hypothetical protein 0.005 0.0846 0.7319
Chlamydia trachomatis enoyl-acyl-carrier protein reductase 0.0194 0.4102 0.5
Schistosoma mansoni hypothetical protein 0.0016 0.0064 0.0549
Trypanosoma cruzi cAMP-specific phosphodiesterase, putative 0.0013 0 0.5
Giardia lamblia Hypothetical protein 0.0013 0 0.5
Giardia lamblia hypothetical protein 0.0013 0 0.5
Wolbachia endosymbiont of Brugia malayi enoyl-ACP reductase 0.0194 0.4102 0.5
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0013 0 0.5
Trichomonas vaginalis hypothetical protein 0.0194 0.4102 1
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0013 0 0.5
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) 0.0194 0.4102 0.5
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0484 0.4186
Brugia malayi RNA binding protein 0.0064 0.1157 1
Plasmodium vivax enoyl-acyl carrier protein reductase 0.0194 0.4102 1
Brugia malayi TAR-binding protein 0.0064 0.1157 1
Trypanosoma brucei hypothetical protein, conserved 0.0013 0 0.5

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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