Detailed information for compound 566900

Basic information

Technical information
  • TDR Targets ID: 566900
  • Name: (9R,9aR)-5'-amino-6-hydroxy-spiro[9aH-xanthen e-9,3'-isobenzofuran]-1',3-dione
  • MW: 347.321 | Formula: C20H13NO5
  • H donors: 2 H acceptors: 3 LogP: 1.82 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1C=C[C@@H]2C(=C1)Oc1c([C@]32OC(=O)c2c3cc(N)cc2)ccc(c1)O
  • InChi: 1S/C20H13NO5/c21-10-1-4-13-16(7-10)20(26-19(13)24)14-5-2-11(22)8-17(14)25-18-9-12(23)3-6-15(18)20/h1-9,14,23H,21H2/t14-,20+/m1/s1
  • InChiKey: FNFHESKTMOZARY-VLIAUNLRSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • (9R,9aR)-5'-amino-6-hydroxyspiro[9aH-xanthene-9,3'-isobenzofuran]-1',3-dione
  • (3R,9'aR)-5-azanyl-6'-hydroxy-spiro[2-benzofuran-3,9'-9aH-xanthene]-1,3'-dione
  • (9R,9aR)-5'-amino-6-hydroxy-spiro[9aH-xanthene-9,3'-phthalan]-1',3-quinone
  • (3R,9'aR)-5-amino-6'-hydroxyspiro[2-benzofuran-3,9'-9aH-xanthene]-1,3'-dione

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 0.0118 0.255 0.255
Brugia malayi Steroid receptor seven-up type 2 0.0097 0.1688 0.1688
Brugia malayi nuclear receptor NHR-88 0.0097 0.1688 0.1688
Onchocerca volvulus Huntingtin homolog 0.0118 0.255 1
Loa Loa (eye worm) hypothetical protein 0.0097 0.1688 0.1688
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0097 0.1688 0.1688
Echinococcus multilocularis geminin 0.0179 0.5008 0.3993
Loa Loa (eye worm) hypothetical protein 0.0304 1 1
Echinococcus granulosus geminin 0.0179 0.5008 0.3993
Loa Loa (eye worm) RNA binding protein 0.0123 0.2732 0.2732
Brugia malayi hypothetical protein 0.0118 0.255 0.255
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0097 0.1688 0.1688
Brugia malayi nuclear hormone receptor 0.0097 0.1688 0.1688
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0123 0.2732 0.2732
Mycobacterium ulcerans glutaminase 0.029 0.9432 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0097 0.1688 0.1688
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0097 0.1688 0.1688
Loa Loa (eye worm) hypothetical protein 0.0097 0.1688 0.1688
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0097 0.1688 0.1688
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0097 0.1688 0.1688
Brugia malayi TAR-binding protein 0.0123 0.2732 0.2732
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0097 0.1688 0.1688
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0097 0.1688 0.1688
Loa Loa (eye worm) steroid hormone receptor 0.0097 0.1688 0.1688
Schistosoma mansoni tar DNA-binding protein 0.0123 0.2732 0.1348
Brugia malayi glutaminase DH11.1 0.029 0.9432 0.9432
Echinococcus granulosus muscleblind protein 0.0304 1 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0097 0.1688 0.1688
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0253 0.7975 1
Treponema pallidum fructose-bisphosphate aldolase 0.0285 0.9233 0.5
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0097 0.1688 0.1688
Schistosoma mansoni tar DNA-binding protein 0.0123 0.2732 0.1348
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0097 0.1688 0.1688
Loa Loa (eye worm) hypothetical protein 0.0097 0.1688 0.1688
Schistosoma mansoni glutaminase 0.029 0.9432 1
Echinococcus multilocularis muscleblind protein 1 0.0304 1 1
Loa Loa (eye worm) hypothetical protein 0.0097 0.1688 0.1688
Loa Loa (eye worm) hypothetical protein 0.0097 0.1688 0.1688
Brugia malayi ecdysteroid receptor 0.0097 0.1688 0.1688
Onchocerca volvulus Huntingtin homolog 0.0118 0.255 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0097 0.1688 0.1688
Schistosoma mansoni tar DNA-binding protein 0.0123 0.2732 0.1348
Schistosoma mansoni tar DNA-binding protein 0.0123 0.2732 0.1348
Echinococcus multilocularis muscleblind protein 0.0304 1 1
Schistosoma mansoni hypothetical protein 0.0179 0.5008 0.4287
Loa Loa (eye worm) hypothetical protein 0.0118 0.255 0.255
Brugia malayi RNA binding protein 0.0123 0.2732 0.2732
Loa Loa (eye worm) hypothetical protein 0.0097 0.1688 0.1688
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0285 0.9233 0.5
Loa Loa (eye worm) hypothetical protein 0.0097 0.1688 0.1688
Brugia malayi RNA recognition motif domain containing protein 0.0123 0.2732 0.2732
Brugia malayi Nuclear hormone receptor-like 1 0.0097 0.1688 0.1688
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0097 0.1688 0.1688
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0097 0.1688 0.1688
Giardia lamblia Fructose-bisphosphate aldolase 0.0285 0.9233 0.5
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0097 0.1688 0.1688
Brugia malayi steroid hormone receptor 0.0097 0.1688 0.1688
Echinococcus multilocularis tar DNA binding protein 0.0123 0.2732 0.1256
Schistosoma mansoni hypothetical protein 0.0179 0.5008 0.4287
Loa Loa (eye worm) TAR-binding protein 0.0123 0.2732 0.2732
Trichomonas vaginalis glutaminase, putative 0.029 0.9432 1
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0139 0.3382 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0097 0.1688 0.1688
Loa Loa (eye worm) glutaminase 2 0.029 0.9432 0.9432
Echinococcus granulosus tar DNA binding protein 0.0123 0.2732 0.1256
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0097 0.1688 0.1688
Schistosoma mansoni tar DNA-binding protein 0.0123 0.2732 0.1348
Brugia malayi photoreceptor-specific nuclear receptor 0.0097 0.1688 0.1688
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0097 0.1688 0.1688
Loa Loa (eye worm) glutaminase 0.029 0.9432 0.9432
Loa Loa (eye worm) hypothetical protein 0.0097 0.1688 0.1688
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0097 0.1688 0.1688
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0285 0.9233 0.5
Loa Loa (eye worm) hypothetical protein 0.0304 1 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0097 0.1688 0.1688

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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