Detailed information for compound 1403557

Basic information

Technical information
  • TDR Targets ID: 1403557
  • Name: N-(4-methoxyphenyl)-2-[(5-thiophen-2-yl-1,3,4 -oxadiazol-2-yl)sulfanyl]acetamide
  • MW: 347.412 | Formula: C15H13N3O3S2
  • H donors: 1 H acceptors: 3 LogP: 2.85 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)NC(=O)CSc1nnc(o1)c1cccs1
  • InChi: 1S/C15H13N3O3S2/c1-20-11-6-4-10(5-7-11)16-13(19)9-23-15-18-17-14(21-15)12-3-2-8-22-12/h2-8H,9H2,1H3,(H,16,19)
  • InChiKey: YGVQBWSWNOWXJT-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • N-(4-methoxyphenyl)-2-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
  • N-(4-methoxyphenyl)-2-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]thio]acetamide
  • N-(4-methoxyphenyl)-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanamide
  • ZINC03475068
  • ST5412393
  • D344-9319
  • NCGC00118854-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ubiquitin specific peptidase 1 Starlite/ChEMBL No references

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 potassium voltage gated channel subfamily A 0.0202 0.0752 0.0752
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0205 0.0775 0.0775
Brugia malayi Cyclic-nucleotide gated cation channel 0.0167 0.0442 0.1322
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0205 0.0775 0.2316
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0167 0.0442 0.1322
Loa Loa (eye worm) hypothetical protein 0.0445 0.2867 0.8571
Schistosoma mansoni voltage-gated potassium channel 0.015 0.0297 0.0807
Echinococcus multilocularis potassium voltage gated channel protein 0.0202 0.0752 0.0752
Echinococcus multilocularis potassium:sodium hyperpolarization activated 0.0167 0.0442 0.0442
Loa Loa (eye worm) hypothetical protein 0.0167 0.0442 0.1322
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0167 0.0442 0.1202
Schistosoma mansoni voltage-gated potassium channel 0.0202 0.0752 0.2044
Schistosoma mansoni voltage-gated potassium channel 0.0537 0.3678 1
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0167 0.0442 0.0442
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0205 0.0775 0.0775
Loa Loa (eye worm) voltage-gated potassium channel 0.0123 0.0061 0.0182
Echinococcus multilocularis potassium voltage gated channel subfamily A 0.0198 0.0716 0.0716
Loa Loa (eye worm) hypothetical protein 0.0202 0.0752 0.2247
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0167 0.0442 0.0442
Schistosoma mansoni voltage-gated potassium channel KCNQ 0.0236 0.1042 0.2834
Schistosoma mansoni 60S ribosomal protein L21 0.015 0.0297 0.0807
Echinococcus multilocularis potassium voltage gated channel subfamily KQT 0.0236 0.1042 0.1042
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0167 0.0442 0.1202
Schistosoma mansoni voltage-gated potassium channel 0.0202 0.0752 0.2044
Echinococcus granulosus potassium voltage gated channel protein 0.0202 0.0752 0.0752
Echinococcus granulosus hyperpolarization activated cyclic 0.0167 0.0442 0.0442
Echinococcus granulosus hyperpolarization activated cyclic 0.0167 0.0442 0.0442
Echinococcus granulosus voltage gated potassium channel 0.0205 0.0775 0.0775
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0499 0.3345 0.3345
Schistosoma mansoni voltage-gated potassium channel 0.0205 0.0775 0.2106
Echinococcus multilocularis voltage gated potassium channel 0.0205 0.0775 0.0775
Echinococcus granulosus potassium:sodium hyperpolarization activated 0.0167 0.0442 0.0442
Echinococcus granulosus potassium channel KvQLT family member kqt 1 0.0236 0.1042 0.1042
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0167 0.0442 0.1322
Schistosoma mansoni voltage-gated potassium channel 0.0167 0.0442 0.1202
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0167 0.0442 0.1202
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0167 0.0442 0.1202
Echinococcus granulosus cyclic nucleotide gated cation channel alpha 3 0.0167 0.0442 0.0442
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0387 0.2364 1
Loa Loa (eye worm) hypothetical protein 0.0205 0.0775 0.2316
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0167 0.0442 0.1202
Brugia malayi Voltage-gated potassium channel, KCNQ (Kv7-like) alpha-subunit. C. elegans kqt-1 ortholog 0.0236 0.1042 0.3116
Echinococcus multilocularis hyperpolarization activated cyclic 0.0167 0.0442 0.0442
Echinococcus multilocularis cyclic nucleotide gated cation channel alpha 3 0.0167 0.0442 0.0442
Echinococcus multilocularis hyperpolarization activated cyclic 0.0167 0.0442 0.0442
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0499 0.3345 1
Brugia malayi Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit 0.0202 0.0752 0.2247
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.0167 0.0442 0.0442
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0387 0.2364 1
Schistosoma mansoni voltage-gated potassium channel 0.0537 0.3678 1
Schistosoma mansoni voltage-gated potassium channel 0.0205 0.0775 0.2106
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0499 0.3345 0.3345
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0499 0.3345 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 17.7828 uM PubChem BioAssay. Inhibitors of USP1/UAF1: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference

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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