Detailed information for compound 565914

Basic information

Technical information
  • TDR Targets ID: 565914
  • Name: millettone
  • MW: 378.375 | Formula: C22H18O6
  • H donors: 0 H acceptors: 1 LogP: 3.62 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1c2ccc3c(c2O[C@H]2[C@@H]1c1cc4OCOc4cc1OC2)C=CC(O3)(C)C
  • InChi: 1S/C22H18O6/c1-22(2)6-5-11-14(28-22)4-3-12-20(23)19-13-7-16-17(26-10-25-16)8-15(13)24-9-18(19)27-21(11)12/h3-8,18-19H,9-10H2,1-2H3/t18-,19+/m1/s1
  • InChiKey: TXNSUHKZCOMFPN-MOPGFXCFSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 50376-38-0
  • C10506

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
Entamoeba histolytica hypothetical protein 0.0109 0.6718 1
Brugia malayi RNA recognition motif domain containing protein 0.0065 0.3678 0.3546
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0044 0.2244 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0833 0.3713
Schistosoma mansoni hypothetical protein 0.0107 0.6576 0.9782
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.101 0.4499
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0065 0.3678 0.3546
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.101 0.4499
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.1616 0.7204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0206 0.0916
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.1616 0.7204
Schistosoma mansoni transcription factor LCR-F1 0.0109 0.6718 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0831 0.3702
Brugia malayi RNA binding protein 0.0065 0.3678 0.3546
Trichomonas vaginalis PIKK family atypical protein kinase 0.0038 0.1796 0.8002
Schistosoma mansoni hypothetical protein 0.005 0.2602 0.3679
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.1458 0.6498
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.005 0.2602 0.3679
Loa Loa (eye worm) phosphatidylinositol 3 0.0044 0.2244 0.2081
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0833 0.3713
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0206 0.0916
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0833 0.3713
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0833 0.3713
Loa Loa (eye worm) latrophilin receptor protein 2 0.005 0.2602 0.2446
Giardia lamblia GTOR 0.0044 0.2244 0.5
Brugia malayi Latrophilin receptor protein 2 0.005 0.2602 0.2446
Loa Loa (eye worm) transcription factor SMAD2 0.0121 0.7569 0.7518
Loa Loa (eye worm) hypothetical protein 0.0157 1 1
Entamoeba histolytica hypothetical protein 0.0109 0.6718 1
Schistosoma mansoni tar DNA-binding protein 0.0065 0.3678 0.5333
Toxoplasma gondii target of rapamycin (TOR), putative 0.0033 0.1458 0.5
Echinococcus granulosus GPCR family 2 0.005 0.2602 0.3679
Brugia malayi MH2 domain containing protein 0.0121 0.7569 0.7518
Echinococcus multilocularis tar DNA binding protein 0.0065 0.3678 0.5333
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0035 0.1619 0.6934
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0044 0.2244 0.313
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.2244 1
Loa Loa (eye worm) hypothetical protein 0.0107 0.6576 0.6504
Schistosoma mansoni hypothetical protein 0.005 0.2602 0.3679
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0044 0.2244 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.101 0.4499
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.1616 0.7204
Trichomonas vaginalis PIKK family atypical protein kinase 0.003 0.1234 0.5501
Entamoeba histolytica hypothetical protein 0.0109 0.6718 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.1458 0.6498
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.1168 0.5205
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0044 0.2244 0.2081
Echinococcus granulosus tar DNA binding protein 0.0065 0.3678 0.5333
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.1458 0.6498
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.0991 0.4418
Loa Loa (eye worm) hypothetical protein 0.005 0.2602 0.2446
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0206 0.0916
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0044 0.2244 1
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0044 0.2244 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0121 0.7569 0.7518
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0035 0.1619 0.6934
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0157 1 1
Echinococcus multilocularis GPCR, family 2 0.005 0.2602 0.3679
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.005 0.2602 0.3679
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0044 0.2244 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0206 0.0916
Trypanosoma cruzi target of rapamycin kinase 3 0.0035 0.1619 0.6934
Schistosoma mansoni hypothetical protein 0.005 0.2602 0.3679
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.1458 0.6498
Entamoeba histolytica hypothetical protein 0.0109 0.6718 1
Brugia malayi TAR-binding protein 0.0065 0.3678 0.3546
Schistosoma mansoni hypothetical protein 0.005 0.2602 0.3679
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.1458 0.6498
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.005 0.2602 0.2446
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0831 0.3702
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0109 0.6718 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.2244 1
Brugia malayi latrophilin 2 splice variant baaae 0.0107 0.6576 0.6504
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.2244 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.1616 0.7204
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0044 0.2244 0.313
Schistosoma mansoni tar DNA-binding protein 0.0065 0.3678 0.5333
Brugia malayi hypothetical protein 0.0109 0.6718 0.6649
Schistosoma mansoni tar DNA-binding protein 0.0065 0.3678 0.5333
Brugia malayi Calcitonin receptor-like protein seb-1 0.0157 1 1
Loa Loa (eye worm) TAR-binding protein 0.0065 0.3678 0.3546
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0109 0.6718 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0044 0.2244 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0206 0.0916
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0021 0.0627 0.207
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.1616 0.7204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.1458 0.6498
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.005 0.2602 0.3679
Schistosoma mansoni hypothetical protein 0.0109 0.6718 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.005 0.2602 0.3679
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.0991 0.4418
Schistosoma mansoni tar DNA-binding protein 0.0065 0.3678 0.5333
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.1458 0.6498
Schistosoma mansoni tar DNA-binding protein 0.0065 0.3678 0.5333
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0831 0.3702
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0018 0.0451 0.1204
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0044 0.2244 0.313
Loa Loa (eye worm) RNA binding protein 0.0065 0.3678 0.3546

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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