Detailed information for compound 1795226

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 377.463 | Formula: C20H19N5OS
  • H donors: 1 H acceptors: 3 LogP: 3.46 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CNc1ccc(cc1)N(C(=O)Cn1nnc2c1cccc2)Cc1cscc1
  • InChi: 1S/C20H19N5OS/c1-21-16-6-8-17(9-7-16)24(12-15-10-11-27-14-15)20(26)13-25-19-5-3-2-4-18(19)22-23-25/h2-11,14,21H,12-13H2,1H3
  • InChiKey: RMLYDSUPMGBCJP-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

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 granulosus geminin 0.0195 0.4918 1
Echinococcus multilocularis lamin dm0 0.0031 0.0397 0.0728
Schistosoma mansoni lamin 0.0031 0.0397 0.0728
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0993 0.195
Loa Loa (eye worm) hypothetical protein 0.0031 0.0397 0.0397
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.0993 0.195
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0053 0.0993 0.0993
Echinococcus granulosus lamin 0.0031 0.0397 0.0728
Echinococcus granulosus intermediate filament protein 0.0031 0.0397 0.0728
Loa Loa (eye worm) hypothetical protein 0.0018 0.0042 0.0042
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0993 0.195
Brugia malayi Intermediate filament tail domain containing protein 0.0031 0.0397 0.0397
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0057 0.1123 0.1123
Echinococcus multilocularis musashi 0.0031 0.0397 0.0728
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0053 0.0993 0.0993
Schistosoma mansoni intermediate filament proteins 0.0031 0.0397 0.0728
Echinococcus multilocularis geminin 0.0195 0.4918 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.0382 0.0382
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0993 0.195
Brugia malayi Calcitonin receptor-like protein seb-1 0.0057 0.1123 0.1123
Brugia malayi latrophilin 2 splice variant baaae 0.0039 0.0623 0.0623
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0031 0.0397 0.0397
Onchocerca volvulus 0.038 1 1
Loa Loa (eye worm) intermediate filament protein 0.0031 0.0397 0.0397
Echinococcus multilocularis lamin 0.0031 0.0397 0.0728
Loa Loa (eye worm) latrophilin receptor protein 2 0.0018 0.0042 0.0042
Loa Loa (eye worm) hypothetical protein 0.0039 0.0623 0.0623
Schistosoma mansoni hypothetical protein 0.0039 0.0623 0.1191
Schistosoma mansoni lamin 0.0031 0.0397 0.0728
Brugia malayi intermediate filament protein 0.0031 0.0397 0.0397
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0018 0.0042 0.0042
Loa Loa (eye worm) protein-tyrosine phosphatase 0.038 1 1
Schistosoma mansoni hypothetical protein 0.0195 0.4918 1
Schistosoma mansoni hypothetical protein 0.0195 0.4918 1
Onchocerca volvulus 0.038 1 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0057 0.1123 0.1123
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.0993 0.195
Loa Loa (eye worm) hypothetical protein 0.0057 0.1123 0.1123
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.0993 0.195
Echinococcus granulosus lamin dm0 0.0031 0.0397 0.0728
Brugia malayi Latrophilin receptor protein 2 0.0018 0.0042 0.0042
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.0993 0.195

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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