Detailed information for compound 1843953

Basic information

Technical information
  • TDR Targets ID: 1843953
  • Name: 3-(4-hydroxyphenyl)-2-methylquinazolin-4-one
  • MW: 252.268 | Formula: C15H12N2O2
  • H donors: 1 H acceptors: 2 LogP: 2.08 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: Oc1ccc(cc1)n1c(C)nc2c(c1=O)cccc2
  • InChi: 1S/C15H12N2O2/c1-10-16-14-5-3-2-4-13(14)15(19)17(10)11-6-8-12(18)9-7-11/h2-9,18H,1H3
  • InChiKey: NTYLZXMLRWNIMU-UHFFFAOYSA-N  

Network

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Synonyms

  • 3-(4-hydroxyphenyl)-2-methyl-quinazolin-4-one
  • 3-(4-hydroxyphenyl)-2-methyl-4-quinazolinone
  • AE-848/34086002
  • Oprea1_190092
  • STOCK1S-84283
  • CBMicro_029793
  • ZINC00272077
  • BIM-0029920.P001

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
Mycobacterium tuberculosis Probable lipoprotein aminopeptidase LpqL 0.0058 0.0429 0.5
Echinococcus multilocularis endoplasmic reticulum metallopeptidase 1 0.0058 0.0429 0.0429
Trypanosoma brucei glutaminyl cyclase, putative 0.0058 0.0429 0.5
Trypanosoma cruzi glutaminyl cyclase, putative 0.0058 0.0429 0.5
Echinococcus granulosus endoplasmic reticulum metallopeptidase 1 0.0058 0.0429 0.0429
Schistosoma mansoni glutaminyl cyclase (M28 family) 0.0365 1 1
Toxoplasma gondii hypothetical protein 0.0058 0.0429 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0058 0.0429 0.5
Trichomonas vaginalis Clan MH, family M28, aminopeptidase S-like metallopeptidase 0.0058 0.0429 0.5
Leishmania major glutaminyl cyclase, putative 0.0058 0.0429 0.5
Brugia malayi FXNA 0.0058 0.0429 0.0429
Loa Loa (eye worm) hypothetical protein 0.0365 1 1
Onchocerca volvulus Glutaminyl cyclase homolog 0.0365 1 1
Schistosoma mansoni Fxna peptidase (M28 family) 0.0058 0.0429 0.0429
Echinococcus granulosus glutaminyl peptide cyclotransferase 0.0365 1 1
Trypanosoma cruzi glutaminyl cyclase, putative 0.0058 0.0429 0.5
Echinococcus multilocularis glutaminyl peptide cyclotransferase 0.0365 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0058 0.0429 0.5
Leishmania major hypothetical protein, conserved 0.0058 0.0429 0.5
Mycobacterium ulcerans lipoprotein aminopeptidase LpqL 0.0058 0.0429 0.5
Mycobacterium ulcerans hypothetical protein 0.0058 0.0429 0.5
Loa Loa (eye worm) hypothetical protein 0.0058 0.0429 0.0429
Loa Loa (eye worm) hypothetical protein 0.0058 0.0429 0.0429
Brugia malayi leucyl aminopeptidase 0.0058 0.0429 0.0429
Loa Loa (eye worm) leucyl aminopeptidase 0.0058 0.0429 0.0429
Trichomonas vaginalis conserved hypothetical protein 0.0058 0.0429 0.5
Brugia malayi nicalin 0.0058 0.0429 0.0429
Echinococcus multilocularis endoplasmic reticulum metallopeptidase 1 0.0058 0.0429 0.0429
Schistosoma mansoni NAALADASE L peptidase (M28 family) 0.0058 0.0429 0.0429
Echinococcus granulosus endoplasmic reticulum metallopeptidase 1 0.0058 0.0429 0.0429
Loa Loa (eye worm) hypothetical protein 0.0058 0.0429 0.0429
Schistosoma mansoni nicalin (M28 family) 0.0058 0.0429 0.0429
Schistosoma mansoni glutaminyl-peptide cyclotransferase-related 0.0058 0.0429 0.0429
Mycobacterium tuberculosis Conserved protein 0.0058 0.0429 0.5
Echinococcus multilocularis n acetylated alpha linked acidic dipeptidase 2 0.0058 0.0429 0.0429
Loa Loa (eye worm) hypothetical protein 0.0058 0.0429 0.0429
Toxoplasma gondii peptidase, M28 family protein 0.0058 0.0429 0.5

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) Antibacterial activity against Escherichia coli at 100 ug after 24 hr by cup-plate method ChEMBL. No reference
Activity (functional) = 10.52 % Antimalarial activity against Plasmodium yoelii N-67 infected Swiss mouse assessed as parasitemia at 200 mg/kg, ip qd administered 4 days measured 24 hr post last treatment (Rvb = 12.36 +/- 1.14 %) ChEMBL. No reference
Activity (functional) = 16.8 % Antimalarial activity against Plasmodium yoelii N-67 infected Swiss mouse assessed as parasitemia at 200 mg/kg, ip qd administered 4 days measured on day 7 (Rvb = 19.5 +/- 0.76 %) ChEMBL. No reference
MST (functional) = 6.8 day Antimalarial activity against Plasmodium yoelii N-67 infected Swiss mouse assessed as mean survival time at 200 mg/kg, ip qd administered 4 days measured 24 hr post last treatment (Rvb = 8.2 +/- 0.86 days) 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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