Detailed information for compound 1001955

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 282.418 | Formula: C17H30O3
  • H donors: 1 H acceptors: 2 LogP: 5.53 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCCCCC1=CC(=O)C(O1)(O)CCCCCC
  • InChi: 1S/C17H30O3/c1-3-5-7-9-10-12-15-14-16(18)17(19,20-15)13-11-8-6-4-2/h14,19H,3-13H2,1-2H3
  • InChiKey: JPBZVOIXIPLNNZ-UHFFFAOYSA-N  


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Network

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Synonyms

No synonyms found for this compound

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
Loa Loa (eye worm) hypothetical protein 0.0025 0.039 0.0338
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1611 0.0857
Loa Loa (eye worm) TAR-binding protein 0.0207 1 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.1611 0.1565
Schistosoma mansoni hypothetical protein 0.0041 0.125 0.0464
Echinococcus granulosus geminin 0.0195 0.9373 0.9317
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1611 0.0857
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.039 0.1596
Brugia malayi hypothetical protein 0.0041 0.125 0.0895
Echinococcus multilocularis muscleblind protein 0.0172 0.8152 0.7986
Schistosoma mansoni tar DNA-binding protein 0.0207 1 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0106 0.4636 0.4418
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0207 1 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0106 0.4636 0.4606
Loa Loa (eye worm) latrophilin receptor protein 2 0.0033 0.0825 0.0775
Echinococcus multilocularis geminin 0.0195 0.9373 0.9317
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.039 0.1406
Loa Loa (eye worm) hypothetical protein 0.0025 0.039 0.0338
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1611 0.0857
Echinococcus granulosus tar DNA binding protein 0.0207 1 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.2446 1
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.039 0.1406
Brugia malayi Muscleblind-like protein 0.0172 0.8152 0.8077
Echinococcus multilocularis muscleblind protein 1 0.0172 0.8152 0.7986
Loa Loa (eye worm) hypothetical protein 0.0033 0.0825 0.0775
Loa Loa (eye worm) hypothetical protein 0.0106 0.4636 0.4606
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0041 0.125 0.0464
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.039 0.1406
Plasmodium vivax acyl-CoA synthetase, putative 0.0019 0.0054 0.5
Schistosoma mansoni hypothetical protein 0.0195 0.9373 0.9317
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0025 0.039 0.5
Entamoeba histolytica hypothetical protein 0.0041 0.125 1
Plasmodium falciparum acyl-CoA synthetase 0.0019 0.0054 0.5
Echinococcus granulosus muscleblind protein 0.0172 0.8152 0.7986
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.039 0.1406
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0064 0.2446 1
Entamoeba histolytica hypothetical protein 0.0041 0.125 1
Schistosoma mansoni tar DNA-binding protein 0.0207 1 1
Entamoeba histolytica hypothetical protein 0.0041 0.125 1
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.039 0.1406
Brugia malayi RNA recognition motif domain containing protein 0.0207 1 1
Toxoplasma gondii aldehyde dehydrogenase 0.0064 0.2446 0.5
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.2446 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0041 0.125 0.0464
Onchocerca volvulus 0.0025 0.039 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.1611 0.0857
Loa Loa (eye worm) hypothetical protein 0.0025 0.039 0.0338
Schistosoma mansoni hypothetical protein 0.0195 0.9373 0.9317
Brugia malayi latrophilin 2 splice variant baaae 0.0072 0.2872 0.2582
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.2446 0.1767
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.1611 0.0857
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.2446 1
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0064 0.2446 1
Brugia malayi Latrophilin receptor protein 2 0.0033 0.0825 0.0452
Schistosoma mansoni tar DNA-binding protein 0.0207 1 1
Loa Loa (eye worm) RNA binding protein 0.0207 1 1
Echinococcus multilocularis tar DNA binding protein 0.0207 1 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.2872 0.2833
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.039 0.1406
Schistosoma mansoni tar DNA-binding protein 0.0207 1 1
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.2446 0.1767
Brugia malayi Calcitonin receptor-like protein seb-1 0.0106 0.4636 0.4418
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0025 0.039 0.5
Entamoeba histolytica hypothetical protein 0.0041 0.125 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.1611 0.0857
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.1611 0.0857
Loa Loa (eye worm) hypothetical protein 0.0172 0.8152 0.8142
Brugia malayi TAR-binding protein 0.0207 1 1
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0064 0.2446 0.1767
Schistosoma mansoni transcription factor LCR-F1 0.0041 0.125 0.0464
Loa Loa (eye worm) hypothetical protein 0.0172 0.8152 0.8142
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0019 0.0054 0.5
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0064 0.2446 0.1767
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0019 0.0054 0.0222
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.039 0.1596
Mycobacterium ulcerans hypothetical protein 0.0025 0.039 0.1406
Schistosoma mansoni hypothetical protein 0.0072 0.2872 0.2231
Schistosoma mansoni tar DNA-binding protein 0.0207 1 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0033 0.0825 0.0452
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.1611 0.127
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.039 0.1406

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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