Detailed information for compound 1522269

Basic information

Technical information
  • TDR Targets ID: 1522269
  • Name: 2-methyl-N-(2-phenyl-1,3-benzoxazol-5-yl)prop anamide
  • MW: 280.321 | Formula: C17H16N2O2
  • H donors: 1 H acceptors: 2 LogP: 3.64 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(C(C)C)Nc1ccc2c(c1)nc(o2)c1ccccc1
  • InChi: 1S/C17H16N2O2/c1-11(2)16(20)18-13-8-9-15-14(10-13)19-17(21-15)12-6-4-3-5-7-12/h3-11H,1-2H3,(H,18,20)
  • InChiKey: QSZRWTXXGVLQGA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-methyl-N-(2-phenyl-1,3-benzoxazol-5-yl)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
Brugia malayi serine/threonine protein kinase 6 0.0114 0.1497 0.1162
Brugia malayi serine/threonine kinase 12 0.0114 0.1497 0.1162
Echinococcus multilocularis ryanodine receptor 44f 0.0525 0.8038 1
Echinococcus granulosus ryanodine receptor 44f 0.0409 0.6201 0.7602
Schistosoma mansoni tyrosine kinase 0.0159 0.221 0.221
Echinococcus multilocularis aurora kinase A 0.0114 0.1497 0.146
Loa Loa (eye worm) hypothetical protein 0.0409 0.6201 1
Onchocerca volvulus 0.0043 0.0379 0.5
Echinococcus granulosus aurora kinase A 0.0114 0.1497 0.146
Schistosoma mansoni ryanodine receptor related 0.0648 1 1
Echinococcus granulosus epidermal growth factor receptor 0.03 0.4454 0.5321
Trichomonas vaginalis AGC family protein kinase 0.0114 0.1497 1
Entamoeba histolytica protein kinase , putative 0.0114 0.1497 1
Brugia malayi cation channel family protein 0.0277 0.4097 0.3864
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0097 0.1226 0.1107
Trypanosoma cruzi inositol 1,4,5-trisphosphate receptor, putative 0.0234 0.3406 1
Giardia lamblia Aurora kinase 0.0114 0.1497 0.5
Trichomonas vaginalis AGC family protein kinase 0.0114 0.1497 1
Schistosoma mansoni tyrosine kinase 0.03 0.4454 0.4454
Plasmodium vivax serine/threonine protein kinase 6, putative 0.0114 0.1497 0.5
Schistosoma mansoni tyrosine kinase 0.0159 0.221 0.221
Schistosoma mansoni inositol 145-trisphosphate receptor 0.0079 0.0944 0.0944
Schistosoma mansoni hypothetical protein 0.016 0.2231 0.2231
Schistosoma mansoni serine/threonine protein kinase 0.0114 0.1497 0.1497
Trypanosoma brucei inositol 1,4,5-trisphosphate receptor 0.0234 0.3406 1
Leishmania major hypothetical protein, conserved 0.0159 0.2215 1
Echinococcus multilocularis insulin receptor 0.0097 0.1226 0.1107
Brugia malayi Protein kinase domain containing protein 0.0097 0.1226 0.0881
Entamoeba histolytica serine/threonine protein kinase 6, putative 0.0114 0.1497 1
Schistosoma mansoni tyrosine kinase 0.0162 0.2259 0.2259
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0162 0.2259 0.2455
Loa Loa (eye worm) AUR protein kinase 0.0114 0.1497 0.1921
Loa Loa (eye worm) hypothetical protein 0.0123 0.165 0.2184
Schistosoma mansoni tyrosine kinase 0.0097 0.1226 0.1226
Loa Loa (eye worm) TK/EGFR protein kinase 0.03 0.4454 0.7
Entamoeba histolytica serine/threonine- protein kinase 6, putative 0.0114 0.1497 1
Schistosoma mansoni inositol 145-trisphosphate receptor 0.0198 0.2841 0.2841
Echinococcus multilocularis ryanodine receptor 44f 0.0409 0.6201 0.7602
Plasmodium falciparum serine/threonine protein kinase, putative 0.0114 0.1497 0.5
Schistosoma mansoni tyrosine kinase 0.0097 0.1226 0.1226
Loa Loa (eye worm) hypothetical protein 0.0079 0.0944 0.0971
Loa Loa (eye worm) ryanodine receptor 0.0242 0.354 0.543
Schistosoma mansoni tyrosine kinase 0.0162 0.2259 0.2259
Loa Loa (eye worm) TK/INSR protein kinase 0.0097 0.1226 0.1456
Trichomonas vaginalis AGC family protein kinase 0.0114 0.1497 1
Echinococcus granulosus ryanodine receptor 44f 0.0525 0.8038 1
Schistosoma mansoni stromal cell-derived factor 2 precursor-like protein 0.0043 0.0379 0.0379
Loa Loa (eye worm) ryanodine receptor 0.0153 0.2122 0.2994
Entamoeba histolytica serine/threonine- protein kinase 6 , putative 0.0114 0.1497 1
Schistosoma mansoni tyrosine kinase 0.0159 0.221 0.221
Schistosoma mansoni protein kinase 0.0114 0.1497 0.1497
Echinococcus multilocularis serine:threonine protein kinase 12 B 0.0114 0.1497 0.146
Trichomonas vaginalis AGC family protein kinase 0.0114 0.1497 1
Brugia malayi Furin-like cysteine rich region family protein 0.03 0.4454 0.4236
Entamoeba histolytica protein kinase, putative 0.0114 0.1497 1
Toxoplasma gondii aurora kinase 0.0114 0.1497 0.5
Echinococcus multilocularis 0.0092 0.1156 0.1015
Echinococcus granulosus insulin receptor 0.0097 0.1226 0.1107
Brugia malayi serine/threonine-protein kinase 6 0.0114 0.1497 0.1162
Entamoeba histolytica protein kinase, putative 0.0114 0.1497 1
Echinococcus granulosus serine:threonine protein kinase 12 B 0.0114 0.1497 0.146
Echinococcus multilocularis epidermal growth factor receptor 0.0162 0.2259 0.2455
Echinococcus multilocularis epidermal growth factor receptor 0.03 0.4454 0.5321
Entamoeba histolytica protein kinase domain containing protein 0.0114 0.1497 1
Echinococcus granulosus epidermal growth factor receptor 0.0162 0.2259 0.2455
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0097 0.1226 0.1107
Loa Loa (eye worm) AUR protein kinase 0.0114 0.1497 0.1921
Loa Loa (eye worm) hypothetical protein 0.0118 0.1569 0.2045
Schistosoma mansoni ryanodine receptor 1 skeletal muscle 0.0075 0.0878 0.0878
Loa Loa (eye worm) AUR protein kinase 0.0114 0.1497 0.1921

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 0.8 uM Activation of UTRN promoter in mouse H2K cells assessed as upregulation of UTRN production after 48 hrs by luciferase reporter linked assay ChEMBL. 21456623

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Mus musculus ChEMBL23 21456623

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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