Detailed information for compound 32354

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 224.255 | Formula: C15H12O2
  • H donors: 1 H acceptors: 2 LogP: 2.25 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1c2ccccc2[C@H]([C@H]1c1ccccc1)O
  • InChi: 1S/C15H12O2/c16-14-11-8-4-5-9-12(11)15(17)13(14)10-6-2-1-3-7-10/h1-9,13-14,16H/t13-,14-/m1/s1
  • InChiKey: BOFWHEVYJRKXQB-ZIAGYGMSSA-N  

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 0.1107 0.1138 0.1138
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.1107 0.1138 0.1138
Brugia malayi Integrin alpha pat-2 precursor 0.0842 0.0704 0.0704
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0996 0.0957 0.0957
Onchocerca volvulus 0.1107 0.1138 0.1138
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.1107 0.1138 0.1138
Loa Loa (eye worm) hypothetical protein 0.6519 1 1
Echinococcus granulosus integrin alpha 3 0.0645 0.0382 0.0382
Brugia malayi hypothetical protein 0.1107 0.1138 0.1138
Loa Loa (eye worm) norepinephrine transporter 0.6519 1 1
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0996 0.0957 0.0957
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0996 0.0957 0.0957
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.1107 0.1138 0.1138
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.1107 0.1138 0.1138
Plasmodium falciparum amino acid transporter, putative 0.1107 0.1138 0.5
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.1107 0.1138 0.1138
Echinococcus granulosus uncharacterized sodium dependent transporter 0.1107 0.1138 0.1138
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.1107 0.1138 0.1138
Treponema pallidum sodium- and chloride- dependent transporter 0.6519 1 0.5
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0996 0.0957 0.0957
Echinococcus multilocularis integrin alpha 3 0.0645 0.0382 0.0382
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0996 0.0957 0.0957
Loa Loa (eye worm) serotonin transporter b 0.6519 1 1
Loa Loa (eye worm) hypothetical protein 0.0996 0.0957 0.0957
Onchocerca volvulus 0.1107 0.1138 0.1138
Loa Loa (eye worm) hypothetical protein 0.1107 0.1138 0.1138
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.1107 0.1138 0.5
Loa Loa (eye worm) solute carrier family 6 member 4 0.6519 1 1
Onchocerca volvulus 0.1107 0.1138 0.1138
Plasmodium falciparum transporter, putative 0.1107 0.1138 0.5
Toxoplasma gondii hypothetical protein 0.1107 0.1138 0.5
Loa Loa (eye worm) hypothetical protein 0.1107 0.1138 0.1138
Echinococcus multilocularis serotonin transporter 0.6519 1 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.1107 0.1138 0.1138
Brugia malayi Sodium:neurotransmitter symporter family protein 0.1107 0.1138 0.1138
Echinococcus multilocularis sodium and chloride dependent glycine 0.1107 0.1138 0.1138
Loa Loa (eye worm) integrin alpha pat-2 0.0842 0.0704 0.0704
Loa Loa (eye worm) hypothetical protein 0.0464 0.0086 0.0086
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.1107 0.1138 0.1138
Echinococcus granulosus serotonin transporter 0.6519 1 1
Echinococcus multilocularis sodium and chloride dependent glycine 0.1107 0.1138 0.1138
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.1107 0.1138 0.5
Loa Loa (eye worm) hypothetical protein 0.0661 0.0408 0.0408
Loa Loa (eye worm) hypothetical protein 0.6519 1 1
Schistosoma mansoni sodium-dependent amino acid transporter 0.1107 0.1138 0.1138
Echinococcus granulosus sodium and chloride dependent glycine 0.1107 0.1138 0.1138
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.1107 0.1138 0.1138
Loa Loa (eye worm) hypothetical protein 0.1107 0.1138 0.1138
Brugia malayi Sodium:neurotransmitter symporter family protein 0.1107 0.1138 0.1138
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.1107 0.1138 0.1138
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.1107 0.1138 0.5
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0996 0.0957 0.0957
Echinococcus granulosus sodium and chloride dependent glycine 0.1107 0.1138 0.1138
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.1107 0.1138 0.1138
Schistosoma mansoni sodium/chloride dependent transporter 0.1107 0.1138 0.1138
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.1107 0.1138 0.1138
Onchocerca volvulus 0.6519 1 1
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.1107 0.1138 0.1138
Loa Loa (eye worm) hypothetical protein 0.1107 0.1138 0.1138
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0996 0.0957 0.0957
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.6519 1 1
Toxoplasma gondii hypothetical protein 0.1107 0.1138 0.5
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.1107 0.1138 0.1138
Onchocerca volvulus Putative nachr subunit 0.0996 0.0957 0.0957
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.1107 0.1138 0.5
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0996 0.0957 0.0957
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.1107 0.1138 0.1138
Schistosoma mansoni integrin alpha 0.0842 0.0704 0.0704
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.1107 0.1138 0.1138
Loa Loa (eye worm) hypothetical protein 0.6519 1 1
Schistosoma mansoni sodium/chloride dependent transporter 0.1107 0.1138 0.1138
Schistosoma mansoni sodium/chloride dependent transporter 0.6519 1 1
Loa Loa (eye worm) hypothetical protein 0.1107 0.1138 0.1138
Loa Loa (eye worm) hypothetical protein 0.1107 0.1138 0.1138
Plasmodium vivax hypothetical protein, conserved 0.1107 0.1138 0.5
Echinococcus granulosus uncharacterized sodium dependent transporter 0.1107 0.1138 0.1138
Brugia malayi Sodium:neurotransmitter symporter family protein 0.1107 0.1138 0.1138
Plasmodium vivax amine transporter, putative 0.1107 0.1138 0.5

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) NA 0 uM In vitro for inhibition of 5-lipoxygenase activity in RBL-1 cells. ChEMBL. No reference

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

No external resources registered for this compound

Bibliographic References

No literature references available for this target.

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