Detailed information for compound 848625

Basic information

Technical information
  • TDR Targets ID: 848625
  • Name: N-[5-[methyl-(3-methylphenyl)sulfamoyl]-1,3,4 -thiadiazol-2-yl]pentanamide
  • MW: 368.474 | Formula: C15H20N4O3S2
  • H donors: 1 H acceptors: 5 LogP: 2.65 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCC(=O)Nc1nnc(s1)S(=O)(=O)N(c1cccc(c1)C)C
  • InChi: 1S/C15H20N4O3S2/c1-4-5-9-13(20)16-14-17-18-15(23-14)24(21,22)19(3)12-8-6-7-11(2)10-12/h6-8,10H,4-5,9H2,1-3H3,(H,16,17,20)
  • InChiKey: CPZAMUVARCKSBI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[5-[methyl-(3-methylphenyl)sulfamoyl]-1,3,4-thiadiazol-2-yl]valeramide

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
Schistosoma mansoni NADPH flavin oxidoreductase 0.0015 0.1706 0.1706
Echinococcus granulosus tyrosine protein kinase Fyn 0.0043 1 1
Trypanosoma brucei NADPH-cytochrome p450 reductase, putative 0.003 0.6254 1
Echinococcus granulosus NADPH cytochrome P450 reductase 0.003 0.6254 0.6254
Brugia malayi FAD binding domain containing protein 0.0019 0.2748 0.2748
Giardia lamblia Hypothetical protein 0.0027 0.5212 0.5
Trypanosoma brucei NADPH-dependent diflavin oxidoreductase 1 0.003 0.6254 1
Schistosoma mansoni tyrosine kinase 0.0043 1 1
Echinococcus granulosus tyrosine protein kinase Lyn 0.0043 1 1
Loa Loa (eye worm) TK protein kinase 0.0038 0.8741 0.8662
Plasmodium vivax NADPH-cytochrome p450 reductase, putative 0.003 0.6254 1
Trichomonas vaginalis sulfite reductase, putative 0.003 0.6254 1
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.003 0.6254 1
Chlamydia trachomatis sulfite reductase 0.0019 0.2748 0.5
Loa Loa (eye worm) FAD binding domain-containing protein 0.003 0.6254 0.6017
Entamoeba histolytica protein kinase, putative 0.0034 0.745 1
Echinococcus granulosus tyrosine protein kinase Src42A 0.0037 0.8379 0.8379
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0043 1 1
Echinococcus granulosus NADPH dependent diflavin oxidoreductase 1 0.003 0.6254 0.6254
Toxoplasma gondii flavodoxin domain-containing protein 0.0015 0.1636 0.5
Leishmania major NADPH-cytochrome p450 reductase-like protein 0.003 0.6254 1
Echinococcus granulosus tyrosine protein kinase Src42A 0.0043 1 1
Echinococcus multilocularis NADPH dependent diflavin oxidoreductase 1 0.003 0.6254 0.6254
Trypanosoma cruzi NADPH-dependent FMN/FAD containing oxidoreductase, putative 0.003 0.6254 1
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0043 1 1
Brugia malayi flavodoxin family protein 0.003 0.6254 0.6254
Brugia malayi flavodoxin family protein 0.0012 0.0594 0.0594
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0043 1 1
Echinococcus granulosus tyrosine protein kinase Src64B 0.0043 1 1
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0043 1 1
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0038 0.8741 0.8741
Echinococcus granulosus tyrosine protein kinase Blk 0.0038 0.8741 0.8741
Leishmania major p450 reductase, putative 0.003 0.6254 1
Loa Loa (eye worm) FAD binding domain-containing protein 0.0019 0.2748 0.229
Echinococcus multilocularis methionine synthase reductase 0.0019 0.2748 0.2748
Echinococcus granulosus tyrosine protein kinase Fyn 0.0043 1 1
Echinococcus multilocularis NADPH cytochrome P450 reductase 0.003 0.6254 0.6254
Toxoplasma gondii flavodoxin domain-containing protein 0.0015 0.1636 0.5
Plasmodium vivax flavodoxin domain containing protein 0.0027 0.5212 0.8159
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0043 1 1
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0043 1 1
Echinococcus granulosus tyrosine kinase 0.0038 0.8741 0.8741
Leishmania major cytochrome P450 reductase, putative 0.0027 0.5212 0.8159
Echinococcus granulosus tyrosine protein kinase HCK 0.0034 0.745 0.745
Echinococcus multilocularis tyrosine protein kinase Blk 0.0038 0.8741 0.8741
Treponema pallidum flavodoxin 0.0012 0.0594 0.5
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0043 1 1
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0043 1 1
Echinococcus multilocularis tyrosine protein kinase HCK 0.0034 0.745 0.745
Schistosoma mansoni cytochrome P450 reductase 0.003 0.6254 0.6254
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0037 0.8379 0.8379
Echinococcus granulosus methionine synthase reductase 0.0019 0.2748 0.2748
Schistosoma mansoni 5-methyl tetrahydrofolate-homocysteine methyltransferase reductase 0.0019 0.2748 0.2748
Plasmodium falciparum nitric oxide synthase, putative 0.003 0.6254 1
Giardia lamblia Nitric oxide synthase, inducible 0.0027 0.5212 0.5
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0043 1 1
Echinococcus multilocularis tyrosine protein kinase Srms 0.0038 0.8741 0.8741
Trypanosoma cruzi p450 reductase, putative 0.003 0.6254 1
Loa Loa (eye worm) hypothetical protein 0.003 0.6254 0.6017
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0043 1 1
Echinococcus granulosus tyrosine protein kinase Fyn 0.0043 1 1
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0038 0.8741 0.8741
Loa Loa (eye worm) TK protein kinase 0.0034 0.745 0.7289
Schistosoma mansoni tyrosine kinase 0.0043 1 1
Mycobacterium ulcerans formate dehydrogenase H FdhF 0.003 0.6254 0.5
Trichomonas vaginalis NADPH fad oxidoreductase, putative 0.0027 0.5212 0.8159
Schistosoma mansoni diflavin oxidoreductase 0.0015 0.1636 0.1636
Brugia malayi protein-tyrosine kinase 0.0038 0.8741 0.8741
Trypanosoma cruzi cytochrome P450 reductase, putative 0.003 0.6254 1
Loa Loa (eye worm) SRC-1 0.0043 1 1
Brugia malayi FAD binding domain containing protein 0.003 0.6254 0.6254
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0043 1 1
Trypanosoma cruzi cytochrome P450 reductase, putative 0.003 0.6254 1
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.003 0.6254 1

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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