Detailed information for compound 836350

Basic information

Technical information
  • TDR Targets ID: 836350
  • Name: 2-[(2-amino-5-bromopyridin-3-yl)sulfonyl-meth ylamino]-N-(3-chloro-4-methoxyphenyl)acetamid e
  • MW: 463.734 | Formula: C15H16BrClN4O4S
  • H donors: 2 H acceptors: 4 LogP: 2.4 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1Cl)NC(=O)CN(S(=O)(=O)c1cc(Br)cnc1N)C
  • InChi: 1S/C15H16BrClN4O4S/c1-21(26(23,24)13-5-9(16)7-19-15(13)18)8-14(22)20-10-3-4-12(25-2)11(17)6-10/h3-7H,8H2,1-2H3,(H2,18,19)(H,20,22)
  • InChiKey: VKUCSZWNAXJXMH-UHFFFAOYSA-N  

Network

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Synonyms

  • 2-[(2-amino-5-bromo-3-pyridyl)sulfonyl-methyl-amino]-N-(3-chloro-4-methoxy-phenyl)acetamide
  • 2-[(2-amino-5-bromo-3-pyridyl)sulfonyl-methylamino]-N-(3-chloro-4-methoxyphenyl)acetamide
  • 2-[(2-amino-5-bromo-pyridin-3-yl)sulfonyl-methyl-amino]-N-(3-chloro-4-methoxy-phenyl)ethanamide

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
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.1227 0.1227
Schistosoma mansoni hypothetical protein 0.0069 0.2758 1
Entamoeba histolytica hypothetical protein 0.0036 0.1227 0.5
Loa Loa (eye worm) hypothetical protein 0.0015 0.0203 0.0597
Brugia malayi hypothetical protein 0.0036 0.1227 0.3502
Echinococcus multilocularis jun protein 0.0085 0.3504 0.3504
Brugia malayi bZIP transcription factor family protein 0.0085 0.3504 1
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0085 0.3504 0.3504
Schistosoma mansoni jun-related protein 0.0069 0.2758 1
Echinococcus multilocularis nuclear factor of activated T cells 5 0.0224 1 1
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0015 0.0203 0.0597
Echinococcus granulosus netrin receptor unc 5 0.0015 0.0203 0.0203
Brugia malayi Death domain containing protein 0.0015 0.0203 0.0578
Echinococcus multilocularis netrin receptor unc 5 0.0015 0.0203 0.0203
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0015 0.0203 0.0203
Schistosoma mansoni netrin receptor unc5 0.0015 0.0203 0.0734
Echinococcus multilocularis Ankyrin 0.0015 0.0208 0.0208
Onchocerca volvulus Netrin receptor homolog 0.0015 0.0203 0.0765
Echinococcus granulosus jun protein 0.0085 0.3504 0.3504
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0015 0.0208 0.0756
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0085 0.3504 0.3504
Schistosoma mansoni hypothetical protein 0.0015 0.0203 0.0734
Schistosoma mansoni hypothetical protein 0.0036 0.1227 0.445
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0203 0.0578
Onchocerca volvulus 0.0067 0.2649 1
Brugia malayi hypothetical protein 0.0067 0.2649 0.7559
Brugia malayi Uncoordinated protein 44 0.0015 0.0203 0.0578
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.1227 0.1227
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.1227 0.445
Loa Loa (eye worm) hypothetical protein 0.0015 0.0208 0.0614
Entamoeba histolytica hypothetical protein 0.0036 0.1227 0.5
Echinococcus granulosus Ankyrin 0.0015 0.0208 0.0208
Schistosoma mansoni ankyrin 23/unc44 0.0015 0.0203 0.0734
Loa Loa (eye worm) hypothetical protein 0.0083 0.3395 1
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0015 0.0203 0.0203
Echinococcus granulosus death domain containing protein 0.0015 0.0203 0.0203
Entamoeba histolytica hypothetical protein 0.0036 0.1227 0.5
Brugia malayi Protein kinase domain containing protein 0.0015 0.0232 0.0661
Entamoeba histolytica hypothetical protein 0.0036 0.1227 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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