Detailed information for compound 675173

Basic information

Technical information
  • TDR Targets ID: 675173
  • Name: 4-ethyl-7-[(2-methoxyphenyl)methoxy]-8-methyl chromen-2-one
  • MW: 324.37 | Formula: C20H20O4
  • H donors: 0 H acceptors: 1 LogP: 4.06 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCc1cc(=O)oc2c1ccc(c2C)OCc1ccccc1OC
  • InChi: 1S/C20H20O4/c1-4-14-11-19(21)24-20-13(2)17(10-9-16(14)20)23-12-15-7-5-6-8-18(15)22-3/h5-11H,4,12H2,1-3H3
  • InChiKey: VNVVKTDYOUYTTC-UHFFFAOYSA-N  

Network

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Synonyms

  • 4-ethyl-7-[(2-methoxyphenyl)methoxy]-8-methyl-chromen-2-one
  • 4-ethyl-7-[(2-methoxyphenyl)methoxy]-8-methyl-2-chromenone
  • 4-ethyl-7-(2-methoxybenzyl)oxy-8-methyl-coumarin
  • Oprea1_608676
  • Oprea1_555917
  • ZINC00307871

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 leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0083 0.6416
Loa Loa (eye worm) inositol-1 0.0036 0.0149 0.0149
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0603 0.3002 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0083 0.0083
Loa Loa (eye worm) hypothetical protein 0.0146 0.0701 0.0702
Loa Loa (eye worm) hypothetical protein 0.0017 0.0053 0.0053
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0083 0.0083
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0023 0.0083 0.5587
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0036 0.0149 0.5
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0023 0.0083 0.5587
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0083 0.5587
Plasmodium vivax acyl-CoA synthetase, putative 0.0017 0.0053 1
Brugia malayi Muscleblind-like protein 0.0146 0.0701 0.0701
Echinococcus multilocularis muscleblind protein 0.0146 0.0701 0.0701
Loa Loa (eye worm) hypothetical protein 0.06 0.2987 0.2991
Schistosoma mansoni inositol monophosphatase 0.0036 0.0149 0.0149
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.0083 0.6416
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0036 0.0149 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0083 0.5587
Loa Loa (eye worm) hypothetical protein 0.1989 0.9985 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0149 0.0495
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0023 0.0083 0.5587
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0049 0.3749
Echinococcus granulosus mitogen activated protein kinase kinase kinase 0.1992 1 1
Echinococcus granulosus inositol monophosphatase 1 0.0036 0.0149 0.0149
Echinococcus multilocularis inositol monophosphatase 1 0.0036 0.0149 0.0149
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0149 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0053 0.0053
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0083 0.5587
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0017 0.0053 0.5
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.1992 1 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.0083 0.6416
Loa Loa (eye worm) STE/STE11/ASK protein kinase 0.0603 0.3002 0.3006
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0083 0.5587
Schistosoma mansoni protein kinase 0.1992 1 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0149 0.0495
Echinococcus granulosus muscleblind protein 0.0146 0.0701 0.0701
Loa Loa (eye worm) hypothetical protein 0.0023 0.0083 0.0083
Loa Loa (eye worm) hypothetical protein 0.0146 0.0701 0.0702
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0603 0.3002 1
Echinococcus multilocularis geminin 0.0167 0.0805 0.0805
Trichomonas vaginalis inositol monophosphatase, putative 0.0036 0.0149 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0053 0.0053
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0049 0.3749
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0149 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0083 0.5587
Brugia malayi Inositol-1 0.0036 0.0149 0.0149
Echinococcus granulosus geminin 0.0167 0.0805 0.0805
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0149 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0049 0.3749
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0083 0.5587
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0023 0.0083 0.5587
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0017 0.0053 0.3588
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0083 0.5587
Echinococcus multilocularis muscleblind protein 1 0.0146 0.0701 0.0701
Onchocerca volvulus 0.0023 0.0083 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0053 0.0053
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0036 0.0149 1
Schistosoma mansoni hypothetical protein 0.0167 0.0805 0.0805
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0017 0.0053 0.412
Mycobacterium ulcerans hypothetical protein 0.0023 0.0083 0.5587
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0049 0.3749
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0036 0.0149 1
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0149 1
Schistosoma mansoni inositol monophosphatase 0.0036 0.0149 0.0149
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0033 0.0129 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0053 0.0053
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0083 0.6416
Schistosoma mansoni protein kinase 0.1992 1 1
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0033 0.0129 1
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0083 0.0083
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0793 0.3959 0.3959
Entamoeba histolytica acyl-coA synthetase, putative 0.0023 0.0083 0.5587
Loa Loa (eye worm) hypothetical protein 0.0023 0.0083 0.0083
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0083 0.0083
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0083 0.5587
Plasmodium falciparum acyl-CoA synthetase 0.0017 0.0053 1
Schistosoma mansoni hypothetical protein 0.0167 0.0805 0.0805

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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