Detailed information for compound 541360

Basic information

Technical information
  • TDR Targets ID: 541360
  • Name: (6S,8aS)-2-hydroxy-4-methoxy-6,8a-dimethyl-6, 7-dihydropyrano[2,3-b]pyran-5-one
  • MW: 226.226 | Formula: C11H14O5
  • H donors: 1 H acceptors: 2 LogP: 0.62 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC1=C2C(=O)[C@@H](C)CO[C@]2(OC(=C1)O)C
  • InChi: 1S/C11H14O5/c1-6-5-15-11(2)9(10(6)13)7(14-3)4-8(12)16-11/h4,6,12H,5H2,1-3H3/t6-,11-/m0/s1
  • InChiKey: GKNWJPAIDQPYNX-KGFZYKRKSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • chlamydosporal
  • 134152-11-7
  • 2H,7H-Pyrano(2,3-b)pyran-2-one, 6,8a-dihydro-5-hydroxy-4-methoxy-6,8a-dimethyl-, trans-
  • 5-Hydroxy-4-methoxy-6,8a-dimethyl-6,7-dihydro-2H,8aH-pyrano(2,3-b)-pyran-2-one
  • 6alpha-Chlamydosporal
  • 6beta-Chlamydosporal
  • trans-6,8a-Dihydro-5-hydroxy-4-methoxy-6,8a-dimethyl-2H,7H-pyrano(2,3-b)pyran-2-one

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) cytochrome P450 family protein 0.005 0.0168 0.0159
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0033 0.0066 0.5
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0033 0.0066 0.5
Mycobacterium leprae putative cytochrome p450 0.0033 0.0066 0.5
Treponema pallidum sodium- and chloride- dependent transporter 0.1635 1 0.5
Echinococcus granulosus cytochrome P450 2K1 0.0033 0.0066 0.0056
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.005 0.0168 1
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0278 0.1581 0.1573
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0278 0.1581 0.1573
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0278 0.1581 0.1573
Loa Loa (eye worm) cytochrome P450 family protein 0.005 0.0168 0.0159
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0278 0.1581 0.1561
Schistosoma mansoni sodium/chloride dependent transporter 0.1635 1 1
Echinococcus multilocularis microtubule associated protein 2 0.0726 0.4365 0.4359
Loa Loa (eye worm) hypothetical protein 0.0278 0.1581 0.1573
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0278 0.1581 0.1561
Loa Loa (eye worm) hypothetical protein 0.0278 0.1581 0.1573
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0278 0.1581 0.1573
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0278 0.1581 0.1573
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0033 0.0066 0.5
Plasmodium vivax hypothetical protein, conserved 0.0278 0.1581 0.5
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0278 0.1581 0.1573
Echinococcus multilocularis serotonin transporter 0.1635 1 1
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0278 0.1581 0.1573
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0278 0.1581 0.1561
Echinococcus multilocularis sodium and chloride dependent glycine 0.0278 0.1581 0.1573
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0033 0.0066 0.5
Echinococcus multilocularis 0.0033 0.0066 0.0056
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0033 0.0066 0.5
Schistosoma mansoni sodium/chloride dependent transporter 0.0278 0.1581 0.1561
Echinococcus granulosus sodium and chloride dependent glycine 0.0278 0.1581 0.1573
Loa Loa (eye worm) cytochrome P450 0.0033 0.0066 0.0056
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0033 0.0066 0.5
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0033 0.0066 0.5
Brugia malayi Cytochrome P450 family protein 0.0105 0.0511 0.0502
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.1635 1 1
Toxoplasma gondii hypothetical protein 0.0278 0.1581 1
Loa Loa (eye worm) hypothetical protein 0.0278 0.1581 0.1573
Loa Loa (eye worm) hypothetical protein 0.0278 0.1581 0.1573
Loa Loa (eye worm) hypothetical protein 0.0133 0.0684 0.0675
Schistosoma mansoni sodium-dependent amino acid transporter 0.0278 0.1581 0.1561
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0278 0.1581 1
Loa Loa (eye worm) solute carrier family 6 member 4 0.1635 1 1
Plasmodium vivax amine transporter, putative 0.0278 0.1581 0.5
Brugia malayi Cytochrome P450 family protein 0.005 0.0168 0.0159
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0033 0.0066 0.5
Echinococcus granulosus serotonin transporter 0.1635 1 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0278 0.1581 0.1573
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0033 0.0066 0.5
Echinococcus granulosus microtubule associated protein 2 0.0726 0.4365 0.4359
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0278 0.1581 0.1561
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0033 0.0066 0.5
Brugia malayi cytochrome P450 0.0033 0.0066 0.0056
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0033 0.0066 0.5
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0033 0.0066 0.5
Brugia malayi Cytochrome P450 family protein 0.005 0.0168 0.0159
Loa Loa (eye worm) hypothetical protein 0.0278 0.1581 0.1573
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0278 0.1581 0.1573
Echinococcus multilocularis sodium and chloride dependent glycine 0.0278 0.1581 0.1573
Loa Loa (eye worm) hypothetical protein 0.0278 0.1581 0.1573
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0278 0.1581 0.1573
Leishmania major cytochrome p450-like protein 0.005 0.0168 1
Trypanosoma brucei cytochrome P450, putative 0.005 0.0168 1
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0278 0.1581 0.1561
Toxoplasma gondii hypothetical protein 0.0278 0.1581 1
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0278 0.1581 0.1573
Trypanosoma cruzi cytochrome P450, putative 0.005 0.0168 1
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0278 0.1581 0.1573
Schistosoma mansoni hypothetical protein 0.0033 0.0066 0.0043
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0033 0.0066 0.5
Loa Loa (eye worm) serotonin transporter b 0.1635 1 1
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0033 0.0066 0.5
Onchocerca volvulus 0.1635 1 1
Schistosoma mansoni alzheimer's disease beta-amyloid related 0.0114 0.057 0.0548
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0033 0.0066 0.5
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0278 0.1581 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0105 0.0511 0.0502
Schistosoma mansoni sodium/chloride dependent transporter 0.0278 0.1581 0.1561
Plasmodium falciparum transporter, putative 0.0278 0.1581 0.5
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0278 0.1581 1
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0033 0.0066 0.5
Brugia malayi hypothetical protein 0.0278 0.1581 0.1573
Mycobacterium leprae Conserved hypothetical protein 0.0033 0.0066 0.5
Brugia malayi Amyloid A4 extracellular domain containing protein 0.0314 0.1807 0.1799
Loa Loa (eye worm) hypothetical protein 0.1635 1 1
Trypanosoma cruzi cytochrome P450, putative 0.005 0.0168 1
Loa Loa (eye worm) hypothetical protein 0.0247 0.1394 0.1386
Plasmodium falciparum amino acid transporter, putative 0.0278 0.1581 0.5
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0033 0.0066 0.5
Schistosoma mansoni cytochrome P450 0.0033 0.0066 0.0043
Loa Loa (eye worm) hypothetical protein 0.0066 0.0272 0.0262
Loa Loa (eye worm) hypothetical protein 0.1635 1 1
Loa Loa (eye worm) hypothetical protein 0.0284 0.1619 0.1611
Schistosoma mansoni microtubule-associated protein tau 0.0726 0.4365 0.4352
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0033 0.0066 0.5
Loa Loa (eye worm) hypothetical protein 0.0284 0.1619 0.1611
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0033 0.0066 0.5
Brugia malayi Cytochrome P450 family protein 0.0033 0.0066 0.0056
Loa Loa (eye worm) norepinephrine transporter 0.1635 1 1
Loa Loa (eye worm) hypothetical protein 0.0278 0.1581 0.1573
Echinococcus granulosus sodium and chloride dependent glycine 0.0278 0.1581 0.1573
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0278 0.1581 0.1561
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0023 0 0.5
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0033 0.0066 0.5
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0278 0.1581 0.1561
Loa Loa (eye worm) hypothetical protein 0.1635 1 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0278 0.1581 0.1573
Loa Loa (eye worm) CYP4Cod1 0.005 0.0168 0.0159
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0023 0 0.5
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0278 0.1581 0.1561
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.0278 0.1581 0.5

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.