Detailed information for compound 1690376

Basic information

Technical information
  • TDR Targets ID: 1690376
  • Name: 2-[(2S)-6-hydroxy-2,5,7,8-tetramethylchroman- 2-yl]ethyl-trimethylphosphanium
  • MW: 309.403 | Formula: C18H30O2P+
  • H donors: 1 H acceptors: 1 LogP: 3.36 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1c2O[C@@](C)(CCc2c(c(c1C)O)C)CC[P+](C)(C)C
  • InChi: 1S/C18H29O2P/c1-12-13(2)17-15(14(3)16(12)19)8-9-18(4,20-17)10-11-21(5,6)7/h8-11H2,1-7H3/p+1/t18-/m0/s1
  • InChiKey: CGZNPABCYYQGEF-SFHVURJKSA-O  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[(2S)-6-hydroxy-2,5,7,8-tetramethyl-chroman-2-yl]ethyl-trimethyl-phosphonium
  • 2-[(2S)-6-hydroxy-2,5,7,8-tetramethyl-2-chromanyl]ethyl-trimethylphosphonium
  • 2-[(2S)-6-hydroxy-2,5,7,8-tetramethyl-chroman-2-yl]ethyl-trimethyl-phosphanium

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
Schistosoma mansoni tar DNA-binding protein 0.0134 0.4807 0.6803
Schistosoma mansoni hypothetical protein 0.0034 0.1005 0.1423
Echinococcus multilocularis GPCR, family 2 0.0034 0.1005 0.1423
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.1259 0.1781
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.1395 0.1974
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0991 0.1402
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0034 0.1005 0.1149
Entamoeba histolytica hypothetical protein 0.0039 0.1189 0.5
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0069 0.2334 0.3303
Echinococcus granulosus tar DNA binding protein 0.0134 0.4807 0.6803
Echinococcus granulosus beta LACTamase domain containing family member 0.0041 0.1259 0.1781
Schistosoma mansoni hypothetical protein 0.0193 0.7066 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0991 0.1133
Loa Loa (eye worm) TAR-binding protein 0.0134 0.4807 0.5494
Schistosoma mansoni tar DNA-binding protein 0.0134 0.4807 0.6803
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0109 0.3844 0.4393
Loa Loa (eye worm) transcription factor SMAD2 0.0118 0.4215 0.4818
Loa Loa (eye worm) hypothetical protein 0.0109 0.3844 0.4393
Loa Loa (eye worm) hypothetical protein 0.0041 0.1259 0.1439
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0034 0.1005 0.1423
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.1395 0.1594
Trypanosoma cruzi hypothetical protein, conserved 0.0041 0.1259 0.5
Echinococcus granulosus geminin 0.0193 0.7066 1
Brugia malayi Pre-SET motif family protein 0.0034 0.0991 0.1133
Loa Loa (eye worm) beta-lactamase 0.0041 0.1259 0.1439
Onchocerca volvulus 0.0041 0.1259 0.0297
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0262 0.9702 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0041 0.1259 0.1439
Schistosoma mansoni tar DNA-binding protein 0.0134 0.4807 0.6803
Loa Loa (eye worm) RNA binding protein 0.0134 0.4807 0.5494
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0134 0.4807 0.5494
Brugia malayi hypothetical protein 0.0039 0.1189 0.1359
Brugia malayi MH2 domain containing protein 0.0118 0.4215 0.4818
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0991 0.1402
Toxoplasma gondii aldehyde dehydrogenase 0.0069 0.2334 1
Toxoplasma gondii ABC1 family protein 0.0041 0.1259 0.1993
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0237 0.8749 1
Echinococcus multilocularis tar DNA binding protein 0.0134 0.4807 0.6803
Trypanosoma cruzi hypothetical protein, conserved 0.0041 0.1259 0.5
Mycobacterium leprae Probable lipase LipE 0.0041 0.1259 0.5
Loa Loa (eye worm) hypothetical protein 0.0041 0.1259 0.1439
Mycobacterium ulcerans aldehyde dehydrogenase 0.0069 0.2334 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.1259 0.1439
Mycobacterium leprae conserved hypothetical protein 0.0041 0.1259 0.5
Schistosoma mansoni hypothetical protein 0.0034 0.1005 0.1423
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0991 0.1402
Entamoeba histolytica hypothetical protein 0.0039 0.1189 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0109 0.3844 0.4393
Loa Loa (eye worm) MH2 domain-containing protein 0.0118 0.4215 0.4818
Brugia malayi TAR-binding protein 0.0134 0.4807 0.5494
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1395 0.1974
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0069 0.2334 0.1274
Schistosoma mansoni hypothetical protein 0.0193 0.7066 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0069 0.2334 1
Brugia malayi RNA binding protein 0.0134 0.4807 0.5494
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.0943 0.1335
Brugia malayi latrophilin 2 splice variant baaae 0.0074 0.253 0.2892
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.1395 0.1974
Loa Loa (eye worm) hypothetical protein 0.0041 0.1259 0.1439
Onchocerca volvulus 0.0041 0.1259 0.0297
Schistosoma mansoni hypothetical protein 0.0039 0.1189 0.1682
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0041 0.1259 0.1439
Entamoeba histolytica hypothetical protein 0.0039 0.1189 0.5
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.1395 0.1594
Echinococcus multilocularis geminin 0.0193 0.7066 1
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0034 0.0991 0.1402
Loa Loa (eye worm) hypothetical protein 0.0074 0.253 0.2892
Brugia malayi beta-lactamase family protein 0.0041 0.1259 0.1439
Trypanosoma brucei hypothetical protein, conserved 0.0041 0.1259 0.5
Loa Loa (eye worm) hypothetical protein 0.0041 0.1259 0.1439
Schistosoma mansoni hypothetical protein 0.0034 0.1005 0.1423
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0034 0.1005 0.1423
Brugia malayi Calcitonin receptor-like protein seb-1 0.0109 0.3844 0.4393
Brugia malayi beta-lactamase family protein 0.0041 0.1259 0.1439
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.1395 0.1974
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0039 0.1189 0.1682
Onchocerca volvulus 0.0041 0.1259 0.0297
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0991 0.1402
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0991 0.1402
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1395 0.1974
Plasmodium vivax hypothetical protein, conserved 0.0041 0.1259 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.1259 0.1781
Brugia malayi Pre-SET motif family protein 0.0237 0.8749 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.1395 0.1974
Schistosoma mansoni tar DNA-binding protein 0.0134 0.4807 0.6803
Brugia malayi Latrophilin receptor protein 2 0.0034 0.1005 0.1149
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0069 0.2334 1
Echinococcus granulosus GPCR family 2 0.0034 0.1005 0.1423
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0069 0.2334 0.3303
Loa Loa (eye worm) hypothetical protein 0.0034 0.1005 0.1149
Mycobacterium ulcerans aldehyde dehydrogenase 0.0069 0.2334 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1395 0.1974
Entamoeba histolytica hypothetical protein 0.0039 0.1189 0.5
Brugia malayi RNA recognition motif domain containing protein 0.0134 0.4807 0.5494
Echinococcus multilocularis beta LACTamase domain containing family member 0.0041 0.1259 0.1781
Schistosoma mansoni aldehyde dehydrogenase 0.0069 0.2334 0.3303
Loa Loa (eye worm) hypothetical protein 0.0041 0.1259 0.1439
Trichomonas vaginalis set domain proteins, putative 0.027 1 1
Schistosoma mansoni transcription factor LCR-F1 0.0039 0.1189 0.1682
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0991 0.1402
Loa Loa (eye worm) latrophilin receptor protein 2 0.0034 0.1005 0.1149
Schistosoma mansoni tar DNA-binding protein 0.0134 0.4807 0.6803
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0039 0.1189 0.1682
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0034 0.1005 0.1423
Schistosoma mansoni aldehyde dehydrogenase 0.0069 0.2334 0.3303
Schistosoma mansoni hypothetical protein 0.0034 0.1005 0.1423
Schistosoma mansoni hypothetical protein 0.0074 0.253 0.358
Brugia malayi beta-lactamase 0.0041 0.1259 0.1439
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0034 0.1005 0.1423

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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