Detailed information for compound 573206

Basic information

Technical information
  • TDR Targets ID: 573206
  • Name: N-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4 -dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]me thyl]-[hydroxy(phosphonooxy)phosphoryl]oxy-ph osphonamidic acid
  • MW: 609.053 | Formula: C9H15IN3O14P3
  • H donors: 8 H acceptors: 11 LogP: -5.21 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 4
  • SMILES: O[C@@H]1[C@@H](CNP(=O)(OP(=O)(OP(=O)(O)O)O)O)O[C@H]([C@@H]1O)n1cc(I)c(=O)[nH]c1=O
  • InChi: 1S/C9H15IN3O14P3/c10-3-2-13(9(17)12-7(3)16)8-6(15)5(14)4(25-8)1-11-28(18,19)26-30(23,24)27-29(20,21)22/h2,4-6,8,14-15H,1H2,(H,23,24)(H2,11,18,19)(H,12,16,17)(H2,20,21,22)/t4-,5-,6-,8-/m1/s1
  • InChiKey: SVDLUYMZCXGYFB-UAKXSSHOSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-dioxo-1-pyrimidinyl)-2-tetrahydrofuranyl]methyl]-[hydroxy(phosphonooxy)phosphoryl]oxyphosphonamidic acid
  • N-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-dioxo-pyrimidin-1-yl)oxolan-2-yl]methyl]-[hydroxy(phosphonooxy)phosphoryl]oxy-phosphonamidic acid
  • N-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-diketo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl]-[hydroxy(phosphonooxy)phosphoryl]oxy-phosphonamidic acid
  • N-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl]-[hydroxy(phosphonooxy)phosphoryl]oxyphosphonamidic acid
  • 5-iodo-5'-amino-2',5'-dideoxyuridine 5'-N'-triphosphate
  • N-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl]-(hydroxy-phosphonooxyphosphoryl)oxyphosphonamidic acid
  • N-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl]-(hydroxy-phosphonooxy-phosphoryl)oxy-phosphonamidic acid
  • N-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-dioxo-1-pyrimidinyl)-2-tetrahydrofuranyl]methyl]-(hydroxy-phosphonooxyphosphoryl)oxyphosphonamidic acid
  • N-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-diketo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl]-(hydroxy-phosphonooxy-phosphoryl)oxy-phosphonamidic acid
  • N-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-dioxo-pyrimidin-1-yl)oxolan-2-yl]methyl]-(hydroxy-phosphonooxy-phosphoryl)oxy-phosphonamidic acid
  • 60658-58-4
  • 2',5'-Dideoxy-5'-((hydroxy((hydroxy(phosphonooxy) phosphinyl)oxy)phosphinyl)amino)-5-iodouridine

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
Onchocerca volvulus 0.0047 0.145 0.1591
Loa Loa (eye worm) hypothetical protein 0.0025 0.0517 0.0351
Trichomonas vaginalis glucosylceramidase, putative 0.0174 0.6756 0.6695
Treponema pallidum NADH oxidase 0.0017 0.0185 0.5
Schistosoma mansoni hypothetical protein 0.0176 0.6848 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0513 0.2484
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0172 0.0172
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0076 0.2652 0.2774
Plasmodium vivax thioredoxin reductase, putative 0.0048 0.1503 1
Entamoeba histolytica hypothetical protein 0.0076 0.2652 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0517 0.2513
Loa Loa (eye worm) hypothetical protein 0.0052 0.1652 0.1506
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.6385 0.6316
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.1652 0.1506
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.1437 0.1415
Brugia malayi hypothetical protein 0.023 0.9113 0.9113
Toxoplasma gondii thioredoxin reductase 0.0048 0.1503 1
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0122 0.46 1
Loa Loa (eye worm) glutathione reductase 0.0048 0.1503 0.1354
Schistosoma mansoni hypothetical protein 0.0176 0.6848 1
Giardia lamblia NADH oxidase lateral transfer candidate 0.0017 0.0185 0.5
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0517 0.2513
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.6385 0.6316
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1437 0.1895
Loa Loa (eye worm) hypothetical protein 0.0018 0.0256 0.0086
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0076 0.2652 0.2774
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0513 0.2484
Schistosoma mansoni transcription factor LCR-F1 0.0076 0.2652 0.3715
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.6385 0.6316
Echinococcus multilocularis muscleblind protein 1 0.0155 0.5976 0.6491
Brugia malayi hypothetical protein 0.0016 0.0149 0.0149
Entamoeba histolytica hypothetical protein 0.0076 0.2652 1
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0256 0.016
Brugia malayi Muscleblind-like protein 0.0155 0.5976 0.5976
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.0517 1
Echinococcus multilocularis survival motor neuron protein 1 0.023 0.9113 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0967 0.0809
Loa Loa (eye worm) hypothetical protein 0.023 0.9113 0.9098
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Mycobacterium tuberculosis Probable reductase 0.011 0.4086 0.8837
Mycobacterium tuberculosis Putative ferredoxin reductase 0.011 0.4086 0.8837
Plasmodium falciparum thioredoxin reductase 0.0048 0.1503 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.0517 1
Brugia malayi glutathione reductase 0.0048 0.1503 0.1503
Mycobacterium tuberculosis Probable dehydrogenase 0.011 0.4086 0.8837
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0513 0.2484
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1437 0.1895
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.1437 0.1415
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.1652 0.1652
Brugia malayi hypothetical protein 0.0076 0.2652 0.2652
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.1437 0.1415
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.0517 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0122 0.46 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.0517 0.075
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.145 0.145
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.011 0.4086 0.8837
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0018 0.0256 0.2138
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0172 0.0172
Schistosoma mansoni hypothetical protein 0.0035 0.0967 0.1191
Echinococcus granulosus thioredoxin glutathione reductase 0.0048 0.1503 0.1489
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0513 0.2484
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.1437 0.1288
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0517 0.2513
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0017 0.0185 0.5
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0517 1
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.0256 1
Loa Loa (eye worm) transcription factor SMAD2 0.0129 0.4899 0.481
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.0517 0.075
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0517 0.0517
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.0517 1
Entamoeba histolytica hypothetical protein 0.0076 0.2652 1
Schistosoma mansoni hypothetical protein 0.0076 0.2652 0.3715
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Trypanosoma brucei trypanothione reductase 0.0048 0.1503 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.1437 0.1415
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0017 0.0185 0.0015
Echinococcus granulosus geminin 0.0176 0.6848 0.7466
Echinococcus multilocularis muscleblind protein 0.0155 0.5976 0.6491
Echinococcus granulosus survival motor neuron protein 1 0.023 0.9113 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0517 1
Schistosoma mansoni survival motor neuron protein 0.0047 0.145 0.1915
Onchocerca volvulus Glucosylceramidase homolog 0.0165 0.6385 1
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.6385 0.6316
Trypanosoma cruzi trypanothione reductase, putative 0.0048 0.1503 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0214 0.0065
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Brugia malayi Thioredoxin reductase 0.0048 0.1503 0.1503
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0517 1
Mycobacterium ulcerans hypothetical protein 0.0025 0.0517 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.1652 0.1652
Trichomonas vaginalis glucosylceramidase, putative 0.0174 0.6756 0.6695
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.011 0.4086 0.8743
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0214 0.0065
Loa Loa (eye worm) hypothetical protein 0.0018 0.0256 0.0086
Loa Loa (eye worm) hypothetical protein 0.0018 0.0256 0.0086
Loa Loa (eye worm) hypothetical protein 0.0155 0.5976 0.5906
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.1437 0.1437
Loa Loa (eye worm) thioredoxin reductase 0.0048 0.1503 0.1354
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1437 0.1895
Loa Loa (eye worm) hypothetical protein 0.0018 0.0256 0.0086
Leishmania major trypanothione reductase 0.0048 0.1503 1
Schistosoma mansoni hypothetical protein 0.0047 0.145 0.1915
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0513 0.2484
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.6385 0.6316
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0122 0.46 1
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0256 0.0086
Loa Loa (eye worm) MH2 domain-containing protein 0.0129 0.4899 0.481
Echinococcus multilocularis geminin 0.0176 0.6848 0.7466
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.011 0.4086 0.8837
Echinococcus multilocularis thioredoxin glutathione reductase 0.0048 0.1503 0.1489
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0048 0.1503 0.2985
Plasmodium vivax glutathione reductase, putative 0.0048 0.1503 1
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0017 0.0185 0.002
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0017 0.0185 0.0185
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0214 0.0065
Brugia malayi hypothetical protein 0.0025 0.0513 0.0513
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0513 0.2484
Brugia malayi MH2 domain containing protein 0.0129 0.4899 0.4899
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0517 0.0517
Echinococcus granulosus muscleblind protein 0.0155 0.5976 0.6491
Loa Loa (eye worm) hypothetical protein 0.0025 0.0513 0.0347
Plasmodium falciparum glutathione reductase 0.0048 0.1503 1
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0967 0.0967
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0122 0.46 1
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.6385 0.6316
Plasmodium vivax acyl-CoA synthetase, putative 0.0018 0.0256 0.0537
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0251 1 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0517 0.0351
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0517 0.0517
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0017 0.0185 0.5
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0214 0.0065
Loa Loa (eye worm) hypothetical protein 0.0025 0.0517 0.0351
Entamoeba histolytica hypothetical protein 0.0076 0.2652 1
Leishmania major hypothetical protein, conserved 0.0025 0.0513 0.2484
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.6385 0.6316
Loa Loa (eye worm) hypothetical protein 0.0155 0.5976 0.5906
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0017 0.0185 0.0015
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.011 0.4086 0.8837
Plasmodium falciparum acyl-CoA synthetase 0.0018 0.0256 0.0537
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0513 0.2484

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.