Detailed information for compound 583180

Basic information

Technical information
  • TDR Targets ID: 583180
  • Name: (2S)-2-amino-3-[(2S,3S,4S,5S,6R)-3,4,5-trihyd roxy-6-(hydroxymethyl)tetrahydropyran-2-yl]ox y-butanoic acid
  • MW: 281.26 | Formula: C10H19NO8
  • H donors: 6 H acceptors: 6 LogP: -5.21 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 2
  • SMILES: OC[C@H]1O[C@H](OC([C@@H](C(=O)O)N)C)[C@H]([C@H]([C@@H]1O)O)O
  • InChi: 1S/C10H19NO8/c1-3(5(11)9(16)17)18-10-8(15)7(14)6(13)4(2-12)19-10/h3-8,10,12-15H,2,11H2,1H3,(H,16,17)/t3?,4-,5+,6-,7+,8+,10+/m1/s1
  • InChiKey: DHIKRLNYEAMDOC-NMYAPSBHSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (2S)-2-amino-3-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]butanoic acid
  • (2S)-2-azanyl-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-butanoic acid
  • (2S)-2-amino-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-butyric acid
  • (2S)-2-amino-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoic acid
  • O-mannopyranosylthreonine
  • (2S)-2-amino-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-butanoic acid
  • (2S)-2-amino-3-(alpha-D-mannopyranosyloxy)butanoic acid
  • CHEBI:37557
  • O-(alpha-D-mannopyranosyl)-L-threonine
  • O-(alpha-D-mannosyl)-L-threonine

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
Mycobacterium ulcerans beta-lactamase 0.004 0.0331 0.5
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0036 0.0279 0.0174
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.004 0.0331 0.0718
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0026 0.0141 0.1495
Loa Loa (eye worm) hypothetical protein 0.004 0.0331 0.0718
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0105 0.1232 0.1137
Echinococcus multilocularis beta LACTamase domain containing family member 0.004 0.0331 0.0226
Brugia malayi RNA recognition motif domain containing protein 0.0071 0.076 0.1648
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0071 0.076 0.1648
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0105 0.1232 0.1137
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.004 0.0331 0.5
Loa Loa (eye worm) hypothetical protein 0.0029 0.0185 0.04
Loa Loa (eye worm) hypothetical protein 0.0036 0.0279 0.0606
Echinococcus granulosus tar DNA binding protein 0.0071 0.076 0.066
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0024 0.0107 0.0232
Onchocerca volvulus 0.0348 0.4611 1
Echinococcus granulosus beta LACTamase domain containing family member 0.004 0.0331 0.0226
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0036 0.0279 0.0174
Leishmania major stearic acid desaturase, putative 0.0348 0.4611 1
Schistosoma mansoni hypothetical protein 0.0036 0.0279 0.0174
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0114 0.1362 0.2954
Echinococcus multilocularis GPCR, family 2 0.0036 0.0279 0.0174
Loa Loa (eye worm) TAR-binding protein 0.0071 0.076 0.1648
Loa Loa (eye worm) intermediate filament protein 0.003 0.0192 0.0417
Trypanosoma cruzi fatty acid desaturase, putative 0.0348 0.4611 1
Loa Loa (eye worm) beta-lactamase 0.004 0.0331 0.0718
Brugia malayi TAR-binding protein 0.0071 0.076 0.1648
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0024 0.0107 0.0232
Loa Loa (eye worm) hypothetical protein 0.004 0.0331 0.0718
Leishmania major importin beta-1 subunit, putative 0.0026 0.0141 0.0074
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0036 0.0279 0.0606
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0331 1
Echinococcus granulosus lamin dm0 0.003 0.0192 0.0086
Echinococcus granulosus intermediate filament protein 0.003 0.0192 0.0086
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0105 0.1232 0.1137
Toxoplasma gondii ABC1 family protein 0.004 0.0331 1
Schistosoma mansoni tar DNA-binding protein 0.0071 0.076 0.066
Onchocerca volvulus 0.004 0.0331 0.0314
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0036 0.0279 0.0174
Trypanosoma cruzi importin beta-1 subunit, putative 0.0026 0.0141 0.0074
Schistosoma mansoni hypothetical protein 0.0053 0.0519 0.0416
Loa Loa (eye worm) hypothetical protein 0.004 0.0331 0.0718
Brugia malayi beta-lactamase family protein 0.004 0.0331 0.0718
Mycobacterium leprae Probable lipase LipE 0.004 0.0331 0.5
Onchocerca volvulus 0.0348 0.4611 1
Trypanosoma cruzi fatty acid desaturase, putative 0.0348 0.4611 1
Trypanosoma brucei hypothetical protein, conserved 0.004 0.0331 0.0497
Echinococcus multilocularis survival motor neuron protein 1 0.0261 0.3409 0.3337
Brugia malayi intermediate filament protein 0.003 0.0192 0.0417
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0331 0.0497
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0105 0.1232 0.2671
Schistosoma mansoni hypothetical protein 0.0036 0.0279 0.0174
Leishmania major hypothetical protein, conserved 0.004 0.0331 0.0497
Brugia malayi RNA, U transporter 1 0.0091 0.1049 0.2275
Trypanosoma brucei fatty acid desaturase, putative 0.0348 0.4611 1
Echinococcus granulosus lamin 0.003 0.0192 0.0086
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0036 0.0279 0.0174
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0331 1
Brugia malayi beta-lactamase family protein 0.004 0.0331 0.0718
Loa Loa (eye worm) RNA binding protein 0.0071 0.076 0.1648
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0254 0.331 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0331 0.0718
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0024 0.0107 0.5
Echinococcus multilocularis musashi 0.003 0.0192 0.0086
Trichomonas vaginalis importin beta-1, putative 0.0026 0.0141 0.1495
Schistosoma mansoni hypothetical protein 0.0036 0.0279 0.0174
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0105 0.1232 0.1137
Schistosoma mansoni lamin 0.003 0.0192 0.0086
Plasmodium vivax stearoyl-CoA desaturase (acyl-CoA desaturase, faty acid desaturase), putative 0.0348 0.4611 1
Echinococcus granulosus GPCR family 2 0.0036 0.0279 0.0174
Plasmodium vivax importin-beta 2, putative 0.0032 0.0225 0.0262
Brugia malayi Importin beta-1 subunit 0.0032 0.0225 0.0488
Trypanosoma cruzi fatty acid desaturase, putative 0.0348 0.4611 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0192 0.0417
Loa Loa (eye worm) acyl-CoA desaturase 0.0348 0.4611 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0114 0.1362 0.2954
Schistosoma mansoni tar DNA-binding protein 0.0071 0.076 0.066
Mycobacterium ulcerans hypothetical protein 0.004 0.0331 0.5
Schistosoma mansoni lamin 0.003 0.0192 0.0086
Plasmodium vivax hypothetical protein, conserved 0.004 0.0331 0.0497
Echinococcus multilocularis snurportin 1 0.0343 0.4549 0.449
Echinococcus granulosus importin subunit beta 1 0.0032 0.0225 0.0119
Echinococcus multilocularis lamin 0.003 0.0192 0.0086
Mycobacterium leprae conserved hypothetical protein 0.004 0.0331 0.5
Brugia malayi RNA binding protein 0.0071 0.076 0.1648
Loa Loa (eye worm) hypothetical protein 0.0261 0.3409 0.7392
Leishmania major fatty-acid desaturase, putative 0.0348 0.4611 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.0225 0.0488
Schistosoma mansoni intermediate filament proteins 0.003 0.0192 0.0086
Brugia malayi acyl-CoA desaturase 0.0348 0.4611 1
Brugia malayi Latrophilin receptor protein 2 0.0036 0.0279 0.0606
Trypanosoma brucei importin beta-1 subunit, putative 0.0032 0.0225 0.0262
Plasmodium falciparum stearoyl-CoA desaturase 0.0348 0.4611 1
Echinococcus multilocularis microtubule associated protein 2 0.0736 1 1
Mycobacterium ulcerans lipase LipD 0.004 0.0331 0.5
Schistosoma mansoni hypothetical protein 0.0377 0.5017 0.4963
Echinococcus multilocularis geminin 0.0377 0.5017 0.4963
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0105 0.1232 0.1137
Echinococcus granulosus survival motor neuron protein 1 0.0261 0.3409 0.3337
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0331 0.0226
Loa Loa (eye worm) hypothetical protein 0.0078 0.0861 0.1867
Schistosoma mansoni survival motor neuron protein 0.0053 0.0519 0.0416
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0114 0.1362 0.2954
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0331 0.0226
Schistosoma mansoni hypothetical protein 0.0036 0.0279 0.0174
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.004 0.0331 0.0718
Schistosoma mansoni hypothetical protein 0.0377 0.5017 0.4963
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0105 0.1232 0.1137
Echinococcus multilocularis tar DNA binding protein 0.0071 0.076 0.066
Brugia malayi beta-lactamase 0.004 0.0331 0.0718
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0331 0.0497
Mycobacterium ulcerans esterase/lipase LipP 0.004 0.0331 0.5
Schistosoma mansoni hypothetical protein 0.0078 0.0861 0.0762
Trypanosoma brucei importin beta-1 subunit, putative 0.0032 0.0225 0.0262
Loa Loa (eye worm) hypothetical protein 0.0114 0.1362 0.2954
Loa Loa (eye worm) hypothetical protein 0.004 0.0331 0.0718
Toxoplasma gondii HEAT repeat-containing protein 0.0032 0.0225 0.5271
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0105 0.1232 0.1137
Loa Loa (eye worm) latrophilin receptor protein 2 0.0036 0.0279 0.0606
Schistosoma mansoni importin beta-1 0.0032 0.0225 0.0119
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.003 0.0192 0.0417
Loa Loa (eye worm) hypothetical protein 0.004 0.0331 0.0718
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0331 1
Echinococcus multilocularis importin subunit beta 1 0.0032 0.0225 0.0119
Onchocerca volvulus 0.0053 0.0519 0.0739
Onchocerca volvulus 0.004 0.0331 0.0314
Schistosoma mansoni tar DNA-binding protein 0.0071 0.076 0.066
Plasmodium falciparum importin beta, putative 0.0032 0.0225 0.0262
Trichomonas vaginalis esterase, putative 0.004 0.0331 1
Entamoeba histolytica hypothetical protein 0.0026 0.0141 1
Echinococcus multilocularis lamin dm0 0.003 0.0192 0.0086
Brugia malayi Intermediate filament tail domain containing protein 0.003 0.0192 0.0417
Echinococcus granulosus geminin 0.0377 0.5017 0.4963
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0105 0.1232 0.2671
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0331 1
Schistosoma mansoni hypothetical protein 0.0343 0.4549 0.449
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0026 0.0141 0.1495
Brugia malayi latrophilin 2 splice variant baaae 0.0078 0.0861 0.1867
Echinococcus granulosus snurportin 1 0.0343 0.4549 0.449
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0053 0.0519 0.1125
Schistosoma mansoni microtubule-associated protein tau 0.0736 1 1
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0331 1
Brugia malayi hypothetical protein 0.0261 0.3409 0.7392
Schistosoma mansoni tar DNA-binding protein 0.0071 0.076 0.066
Schistosoma mansoni tar DNA-binding protein 0.0071 0.076 0.066
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0343 0.4549 0.9866
Onchocerca volvulus 0.004 0.0331 0.0314

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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