Detailed information for compound 848599

Basic information

Technical information
  • TDR Targets ID: 848599
  • Name: 2-methyl-N-[5-(methyl-(phenylmethyl)sulfamoyl )-1,3,4-thiadiazol-2-yl]propanamide
  • MW: 354.448 | Formula: C14H18N4O3S2
  • H donors: 1 H acceptors: 5 LogP: 1.89 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(C(=O)Nc1nnc(s1)S(=O)(=O)N(Cc1ccccc1)C)C
  • InChi: 1S/C14H18N4O3S2/c1-10(2)12(19)15-13-16-17-14(22-13)23(20,21)18(3)9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3,(H,15,16,19)
  • InChiKey: WAPUKYIFEIIUBZ-UHFFFAOYSA-N  

Network

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Synonyms

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

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 aminopeptidase PILS (M01 family) 0.0103 0.0628 0.0628
Schistosoma mansoni microtubule-associated protein tau 0.0833 1 1
Trypanosoma cruzi cdc2-related kinase 1 0.0133 0.1013 1
Plasmodium falciparum protein kinase 5 0.0133 0.1013 1
Onchocerca volvulus 0.0103 0.0628 0.1658
Loa Loa (eye worm) hypothetical protein 0.0067 0.0165 0.0495
Schistosoma mansoni serine/threonine protein kinase 0.0133 0.1013 0.1013
Loa Loa (eye worm) aminopeptidase N 0.0103 0.0628 0.1889
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0133 0.1013 0.3045
Entamoeba histolytica cell division protein kinase 2, putative 0.0133 0.1013 1
Entamoeba histolytica cell division protein kinase 2, putative 0.0133 0.1013 1
Brugia malayi Protein kinase domain containing protein 0.0133 0.1013 0.2672
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0103 0.0628 0.0628
Trypanosoma cruzi cdc2-related kinase 1 0.0133 0.1013 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0103 0.0628 0.0628
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0133 0.1013 0.1013
Trichomonas vaginalis glutaminase, putative 0.0247 0.2473 1
Plasmodium vivax protein kinase Crk2 0.0133 0.1013 0.5
Schistosoma mansoni hypothetical protein 0.0153 0.127 0.127
Trypanosoma brucei Aminopeptidase M1, putative 0.0103 0.0628 0.6204
Loa Loa (eye worm) glutaminase 2 0.0247 0.2473 0.7433
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0103 0.0628 0.6204
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0103 0.0628 0.0628
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0103 0.0628 0.6204
Trypanosoma brucei cdc2-related kinase 1 0.0133 0.1013 1
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0067 0.0165 0.0165
Onchocerca volvulus 0.0349 0.379 1
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0103 0.0628 0.2541
Brugia malayi glutaminase DH11.1 0.0247 0.2473 0.6524
Trichomonas vaginalis CMGC family protein kinase 0.0133 0.1013 0.4096
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0103 0.0628 0.0628
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0103 0.0628 0.2541
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0103 0.0628 0.0628
Trichomonas vaginalis CMGC family protein kinase 0.0133 0.1013 0.4096
Loa Loa (eye worm) glutaminase 0.0247 0.2473 0.7433
Echinococcus multilocularis cyclin dependent kinase 1 0.0133 0.1013 0.1013
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0133 0.1013 1
Brugia malayi Peptidase family M1 containing protein 0.0103 0.0628 0.1658
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0103 0.0628 0.6204
Brugia malayi hypothetical protein 0.0103 0.0628 0.1658
Echinococcus multilocularis cyclin dependent kinase 0.0133 0.1013 0.1013
Schistosoma mansoni family M1 non-peptidase homologue (M01 family) 0.0067 0.0165 0.0165
Trypanosoma brucei Aminopeptidase M1, putative 0.0103 0.0628 0.6204
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0103 0.0628 0.0628
Trichomonas vaginalis CMGC family protein kinase 0.0133 0.1013 0.4096
Loa Loa (eye worm) hypothetical protein 0.0067 0.0165 0.0495
Echinococcus multilocularis aminopeptidase N 0.0349 0.379 0.379
Giardia lamblia Kinase, CMGC CDK 0.0133 0.1013 1
Echinococcus multilocularis cyclin dependent kinase 1 0.0133 0.1013 0.1013
Trypanosoma cruzi aminopeptidase, putative 0.0103 0.0628 0.6204
Trypanosoma cruzi cdc2-related kinase 3 0.0133 0.1013 1
Giardia lamblia Kinase, CMGC CDK 0.0133 0.1013 1
Echinococcus granulosus aminopeptidase N 0.0349 0.379 0.379
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0133 0.1013 0.5
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0103 0.0628 0.0628
Echinococcus granulosus cyclin dependent kinase 0.0133 0.1013 0.1013
Echinococcus granulosus cyclin dependent kinase 1 0.0133 0.1013 0.1013
Mycobacterium ulcerans glutaminase 0.0247 0.2473 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.2873 0.5
Loa Loa (eye worm) hypothetical protein 0.0246 0.2471 0.7429
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0133 0.1013 0.3045
Loa Loa (eye worm) peptidase family M1 containing protein 0.0283 0.2935 0.8823
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0103 0.0628 0.0628
Echinococcus multilocularis microtubule associated protein 2 0.0833 1 1
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0103 0.0628 0.0628
Brugia malayi Peptidase family M1 containing protein 0.0349 0.379 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0103 0.0628 0.0628
Echinococcus multilocularis cyclin dependent kinase 5 0.0133 0.1013 0.1013
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0067 0.0165 0.1625
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0103 0.0628 0.0628
Loa Loa (eye worm) hypothetical protein 0.0129 0.097 0.2917
Schistosoma mansoni serine/threonine protein kinase 0.0133 0.1013 0.1013
Echinococcus multilocularis geminin 0.0153 0.127 0.127
Trypanosoma cruzi cdc2-related kinase 3 0.0133 0.1013 1
Echinococcus granulosus cyclin dependent kinase 5 0.0133 0.1013 0.1013
Loa Loa (eye worm) hypothetical protein 0.0313 0.3327 1
Trypanosoma brucei cdc2-related kinase 3 0.0133 0.1013 1
Schistosoma mansoni glutaminase 0.0247 0.2473 0.2473
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0133 0.1013 0.3045
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0103 0.0628 0.6204
Schistosoma mansoni hypothetical protein 0.0153 0.127 0.127
Entamoeba histolytica aminopeptidase, putative 0.0103 0.0628 0.6204
Echinococcus granulosus geminin 0.0153 0.127 0.127
Brugia malayi cell division control protein 2 homolog 0.0133 0.1013 0.2672
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0133 0.1013 1
Trypanosoma cruzi Aminopeptidase M1, putative 0.0103 0.0628 0.6204

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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