Detailed information for compound 568931

Basic information

Technical information
  • TDR Targets ID: 568931
  • Name: 2-amino-3-(carboxymethylsulfinyl)propanoic ac id
  • MW: 195.194 | Formula: C5H9NO5S
  • H donors: 3 H acceptors: 5 LogP: -4.58 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)CS(=O)CC(C(=O)O)N
  • InChi: 1S/C5H9NO5S/c6-3(5(9)10)1-12(11)2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)
  • InChiKey: DUGSIUCROZRSMS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-azanyl-3-(carboxymethylsulfinyl)propanoic acid
  • 2-(2-amino-3-hydroxy-3-keto-propyl)sulfinylacetic acid
  • carbocysteine sulfoxide
  • 5439-87-2
  • 20960-90-1
  • 3-((Carboxymethyl)sulfinyl)alanine
  • Alanine, 3-((carboxymethyl)sulfinyl)-
  • Carbocysteine sulphoxide
  • L-Alanine, 3-((carboxymethyl)sulfinyl)-
  • NSC15388

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
Brugia malayi RNA binding protein 0.0062 0.3012 0.3146
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0162 0.9575 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0036 0.1314 1
Echinococcus multilocularis lamin dm0 0.0027 0.0726 0.0572
Echinococcus multilocularis geminin 0.0168 1 1
Loa Loa (eye worm) hypothetical protein 0.0123 0.7054 0.7321
Leishmania major hypothetical protein, conserved 0.0025 0.0572 0.3545
Echinococcus granulosus tar DNA binding protein 0.0062 0.3012 0.2896
Trichomonas vaginalis maltase-glucoamylase, putative 0.0036 0.1314 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0062 0.3012 0.3027
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0164 0.0171
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0018 0.0164 0.5
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0164 0.5
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.1314 1
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.1314 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.1314 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.4912 0.4827
Brugia malayi Glycosyl hydrolases family 31 protein 0.0162 0.9575 1
Schistosoma mansoni tar DNA-binding protein 0.0062 0.3012 0.2896
Schistosoma mansoni lamin 0.0027 0.0726 0.0572
Schistosoma mansoni tar DNA-binding protein 0.0062 0.3012 0.2896
Brugia malayi RNA recognition motif domain containing protein 0.0062 0.3012 0.3146
Loa Loa (eye worm) hypothetical protein 0.0025 0.0572 0.0433
Schistosoma mansoni alpha-glucosidase 0.0139 0.8096 0.8065
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0164 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.1314 1
Echinococcus multilocularis tar DNA binding protein 0.0062 0.3012 0.2896
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0091 0.4912 0.513
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0572 0.3545
Schistosoma mansoni tar DNA-binding protein 0.0062 0.3012 0.2896
Echinococcus multilocularis lysosomal alpha glucosidase 0.0162 0.9575 0.9568
Echinococcus multilocularis neutral alpha glucosidase AB 0.0036 0.1314 0.117
Loa Loa (eye worm) hypothetical protein 0.0027 0.0726 0.0598
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0572 1
Brugia malayi intermediate filament protein 0.0027 0.0726 0.0758
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0726 0.0598
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0036 0.1314 1
Echinococcus multilocularis musashi 0.0027 0.0726 0.0572
Onchocerca volvulus Huntingtin homolog 0.0123 0.7054 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.4912 0.4827
Schistosoma mansoni hypothetical protein 0.0168 1 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.4912 0.4827
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0091 0.4912 0.5045
Echinococcus granulosus lamin 0.0027 0.0726 0.0572
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0036 0.1314 0.1223
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0036 0.1314 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0.0164 0.5
Schistosoma mansoni alpha-glucosidase 0.0139 0.8096 0.8065
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.1314 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.1314 1
Onchocerca volvulus 0.0094 0.5099 0.691
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0572 1
Brugia malayi TAR-binding protein 0.0062 0.3012 0.3146
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.4912 0.4827
Loa Loa (eye worm) hypothetical protein 0.0026 0.0694 0.0563
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0.0164 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.4912 0.4827
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.4912 0.4827
Trypanosoma brucei glucosidase, putative 0.0036 0.1314 1
Leishmania major alpha glucosidase II subunit, putative 0.0036 0.1314 1
Brugia malayi hypothetical protein 0.0123 0.7054 0.7367
Echinococcus granulosus intermediate filament protein 0.0027 0.0726 0.0572
Echinococcus granulosus lysosomal alpha glucosidase 0.0162 0.9575 0.9568
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.1314 1
Schistosoma mansoni intermediate filament proteins 0.0027 0.0726 0.0572
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.4912 0.4827
Echinococcus granulosus neutral alpha glucosidase AB 0.0036 0.1314 0.117
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0572 0.3545
Brugia malayi hypothetical protein 0.0025 0.0572 0.0597
Schistosoma mansoni tar DNA-binding protein 0.0062 0.3012 0.2896
Echinococcus multilocularis lamin 0.0027 0.0726 0.0572
Echinococcus multilocularis lysosomal alpha glucosidase 0.0162 0.9575 0.9568
Schistosoma mansoni alpha glucosidase 0.0036 0.1314 0.117
Schistosoma mansoni hypothetical protein 0.0168 1 1
Trichomonas vaginalis sucrase-isomaltase, putative 0.0036 0.1314 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0572 0.3545
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0726 0.0758
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0572 0.3545
Schistosoma mansoni lamin 0.0027 0.0726 0.0572
Onchocerca volvulus Huntingtin homolog 0.0123 0.7054 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0036 0.1314 0.1373
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0572 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0036 0.1314 1
Echinococcus granulosus lamin dm0 0.0027 0.0726 0.0572
Schistosoma mansoni tar DNA-binding protein 0.0062 0.3012 0.2896
Loa Loa (eye worm) hypothetical protein 0.0123 0.7054 0.7321
Loa Loa (eye worm) TAR-binding protein 0.0062 0.3012 0.3027
Loa Loa (eye worm) RNA binding protein 0.0062 0.3012 0.3027
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0036 0.1314 1
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0726 0.0598

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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