Detailed information for compound 667453

Basic information

Technical information
  • TDR Targets ID: 667453
  • Name: N-(2-ethylphenyl)-2-[[5-[(4-methylphenoxy)met hyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
  • MW: 383.464 | Formula: C20H21N3O3S
  • H donors: 1 H acceptors: 3 LogP: 4.16 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCc1ccccc1NC(=O)CSc1nnc(o1)COc1ccc(cc1)C
  • InChi: 1S/C20H21N3O3S/c1-3-15-6-4-5-7-17(15)21-18(24)13-27-20-23-22-19(26-20)12-25-16-10-8-14(2)9-11-16/h4-11H,3,12-13H2,1-2H3,(H,21,24)
  • InChiKey: JMFBKVGICHFUDQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(2-ethylphenyl)-2-[[5-[(4-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]acetamide
  • N-(2-ethylphenyl)-2-[[5-[(4-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanamide
  • STK101731
  • ZINC01018387
  • EU-0047541

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
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0016 0.0058 0.0088
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.468 1
Echinococcus multilocularis lamin dm0 0.0033 0.1702 0.1702
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.1702 0.2533
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0016 0.0058 0.0058
Trypanosoma cruzi cysteine peptidase, putative 0.0062 0.468 1
Loa Loa (eye worm) ctsf protein 0.0016 0.0058 0.0088
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0056 0.4049 0.4049
Brugia malayi hypothetical protein 0.0019 0.035 0.045
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0056 0.4049 0.8634
Schistosoma mansoni lamin 0.0033 0.1702 0.1653
Trypanosoma brucei DNA polymerase eta, putative 0.0033 0.1731 0.2588
Echinococcus granulosus dna polymerase kappa 0.0059 0.4343 0.4343
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0016 0.0058 0.0058
Onchocerca volvulus 0.0019 0.035 0.1777
Echinococcus granulosus cathepsin l1 0.0016 0.0058 0.0058
Brugia malayi polk-prov protein 0.0036 0.2055 0.3077
Trypanosoma brucei DNA polymerase kappa, putative 0.0059 0.4343 0.9153
Schistosoma mansoni hypothetical protein 0.0081 0.6548 0.6528
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.035 0.035
Trypanosoma cruzi DNA polymerase kappa, putative 0.0059 0.4343 0.9271
Trypanosoma brucei DNA polymerase kappa, putative 0.0036 0.2055 0.3403
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.468 1
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.035 0.035
Trichomonas vaginalis DNA polymerase eta, putative 0.0059 0.4343 1
Schistosoma mansoni polycystin 1-related 0.0019 0.035 0.0294
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0057 0.4137 0.8824
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0033 0.1731 0.2643
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0033 0.1731 0.1683
Entamoeba histolytica deoxycytidyl transferase, putative 0.0033 0.1731 1
Schistosoma mansoni rab6-interacting 0.0019 0.035 0.0294
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.035 0.035
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0052 0.3669 0.5603
Echinococcus multilocularis RUN 0.0019 0.035 0.035
Echinococcus granulosus lamin 0.0033 0.1702 0.1702
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0056 0.4049 1
Brugia malayi ImpB/MucB/SamB family protein 0.0033 0.1731 0.2578
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0039 0.2379 0.5021
Schistosoma mansoni hypothetical protein 0.0081 0.6548 0.6528
Brugia malayi intermediate filament protein 0.0033 0.1702 0.2533
Trypanosoma cruzi DNA polymerase kappa, putative 0.0059 0.4343 0.9271
Schistosoma mansoni rab6-interacting 0.0019 0.035 0.0294
Trypanosoma brucei DNA polymerase kappa, putative 0.0029 0.1349 0.1629
Onchocerca volvulus 0.0019 0.035 0.1777
Trypanosoma brucei DNA polymerase kappa, putative 0.0059 0.4343 0.9153
Schistosoma mansoni lipoxygenase 0.0115 1 1
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0081 0.6548 0.6548
Schistosoma mansoni intermediate filament proteins 0.0033 0.1702 0.1653
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.468 1
Echinococcus multilocularis cathepsin L cysteine protease 0.0016 0.0058 0.0058
Trypanosoma brucei DNA polymerase IV, putative 0.0059 0.4343 0.9153
Loa Loa (eye worm) hypothetical protein 0.0019 0.035 0.0534
Onchocerca volvulus 0.0033 0.1702 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0029 0.1349 0.1629
Loa Loa (eye worm) intermediate filament protein 0.0033 0.1702 0.2599
Brugia malayi hypothetical protein 0.0019 0.035 0.045
Loa Loa (eye worm) hypothetical protein 0.0033 0.1731 0.2643
Echinococcus multilocularis musashi 0.0033 0.1702 0.1702
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.468 1
Loa Loa (eye worm) hypothetical protein 0.0081 0.6548 1
Leishmania major DNA polymerase eta, putative 0.0033 0.1731 0.3619
Echinococcus granulosus cathepsin L cysteine proteinase 0.0016 0.0058 0.0058
Loa Loa (eye worm) doublecortin family protein 0.0019 0.035 0.0534
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.1702 0.2599
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.468 1
Echinococcus multilocularis cysteine protease 0.0016 0.0058 0.0058
Echinococcus multilocularis dna polymerase eta 0.0033 0.1731 0.1731
Trypanosoma cruzi DNA polymerase eta, putative 0.0033 0.1731 0.3619
Trypanosoma brucei DNA polymerase kappa, putative 0.0029 0.1349 0.1629
Trypanosoma brucei DNA polymerase kappa, putative 0.0036 0.2055 0.3403
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0017 0.0091 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.1702 0.2599
Trypanosoma cruzi cysteine peptidase, putative 0.0062 0.468 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.468 1
Schistosoma mansoni terminal deoxycytidyl transferase 0.0033 0.1731 0.1683
Loa Loa (eye worm) cysteine protease 0.0016 0.0058 0.0088
Schistosoma mansoni lipoxygenase 0.008 0.6513 0.6493
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.2379 0.4217
Schistosoma mansoni hypothetical protein 0.0081 0.6548 0.6528
Loa Loa (eye worm) hypothetical protein 0.0036 0.2055 0.3138
Plasmodium falciparum LCCL domain-containing protein 0.0019 0.035 1
Echinococcus multilocularis dna polymerase kappa 0.0059 0.4343 0.4343
Trypanosoma brucei DNA polymerase IV, putative 0.0052 0.3695 0.7524
Loa Loa (eye worm) hypothetical protein 0.0019 0.035 0.0534
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.468 1
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0081 0.6548 0.6548
Schistosoma mansoni hypothetical protein 0.0019 0.035 0.0294
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0081 0.6548 0.6548
Trypanosoma cruzi cysteine peptidase, putative 0.0062 0.468 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.468 1
Echinococcus granulosus Polycystic kidney disease protein 0.0019 0.035 0.035
Plasmodium vivax multidomain scavenger receptor, putative 0.0019 0.035 1
Schistosoma mansoni lamin 0.0033 0.1702 0.1653
Trypanosoma brucei DNA polymerase kappa, putative 0.0059 0.4343 0.9153
Echinococcus granulosus lamin dm0 0.0033 0.1702 0.1702
Mycobacterium ulcerans DNA polymerase IV 0.0059 0.4343 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0059 0.4343 0.9153
Leishmania major cathepsin L-like protease 0.0062 0.468 1
Echinococcus multilocularis Polycystic kidney disease protein 0.0019 0.035 0.035
Schistosoma mansoni apoptosis regulator bax 0.0081 0.6548 0.6528
Trypanosoma brucei DNA polymerase IV, putative 0.0059 0.4343 0.9153
Trypanosoma cruzi DNA polymerase kappa, putative 0.0059 0.4343 0.9271
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.0175 0.0267
Trypanosoma brucei unspecified product 0.0052 0.3695 0.7524
Onchocerca volvulus 0.0033 0.1702 1
Trypanosoma cruzi cruzipain precursor, putative 0.0062 0.468 1
Loa Loa (eye worm) fibroinase 0.0016 0.0058 0.0088
Trypanosoma brucei DNA polymerase kappa, putative 0.0059 0.4343 0.9153
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0081 0.6548 0.6528
Trypanosoma cruzi DNA polymerase kappa, putative 0.0059 0.4343 0.9271
Echinococcus multilocularis lamin 0.0033 0.1702 0.1702
Echinococcus granulosus cathepsin l cysteine peptidase 0.0016 0.0058 0.0058
Echinococcus granulosus RUN 0.0019 0.035 0.035
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0115 1 1
Giardia lamblia DINP protein human, muc B family 0.0039 0.2379 0.5
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0033 0.1731 0.1731
Echinococcus multilocularis cathepsin L cysteine protease 0.0016 0.0058 0.0058
Trypanosoma brucei DNA polymerase kappa, putative 0.0059 0.4343 0.9153
Brugia malayi cytoplasmic intermediate filament protein 0.0017 0.0175 0.018
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0033 0.1731 0.1731
Trypanosoma brucei DNA polymerase kappa, putative 0.0059 0.4343 0.9153
Trypanosoma brucei DNA polymerase kappa, putative 0.0059 0.4343 0.9153
Leishmania major cathepsin L-like protease 0.0062 0.468 1
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0081 0.6548 0.6548
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0059 0.4343 1
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0039 0.2379 0.2796
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.468 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.468 1
Loa Loa (eye worm) apoptosis regulator protein 0.0081 0.6548 1
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0056 0.4049 0.6149
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0016 0.0058 0.0088
Echinococcus multilocularis cysteine protease 0.0016 0.0058 0.0058
Schistosoma mansoni loxhd1 0.0019 0.035 0.0294
Mycobacterium ulcerans DNA polymerase IV 0.0059 0.4343 1
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.035 0.035
Echinococcus granulosus intermediate filament protein 0.0033 0.1702 0.1702
Trypanosoma brucei DNA polymerase kappa, putative 0.0059 0.4343 0.9153
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0056 0.4049 0.4014
Trypanosoma cruzi major cysteine proteinase, putative 0.0049 0.3339 0.7098
Leishmania major DNA polymerase kappa, putative 0.0039 0.2379 0.5021
Schistosoma mansoni DNA polymerase eta 0.0033 0.1731 0.1683
Loa Loa (eye worm) hypothetical protein 0.0016 0.0058 0.0088
Brugia malayi Doublecortin family protein 0.0019 0.035 0.045
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.468 1
Echinococcus granulosus dna polymerase eta 0.0033 0.1731 0.1731
Brugia malayi ImpB/MucB/SamB family protein 0.0033 0.1731 0.2578
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0081 0.6548 1
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0056 0.4049 0.4049
Loa Loa (eye worm) hypothetical protein 0.0032 0.1642 0.2507
Leishmania major cathepsin L-like protease 0.0062 0.468 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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