Detailed information for compound 563180

Basic information

Technical information
  • TDR Targets ID: 563180
  • Name: (2-isobutylphenyl) diphenyl phosphate
  • MW: 382.389 | Formula: C22H23O4P
  • H donors: 0 H acceptors: 1 LogP: 6.55 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(Cc1ccccc1OP(=O)(Oc1ccccc1)Oc1ccccc1)C
  • InChi: 1S/C22H23O4P/c1-18(2)17-19-11-9-10-16-22(19)26-27(23,24-20-12-5-3-6-13-20)25-21-14-7-4-8-15-21/h3-16,18H,17H2,1-2H3
  • InChiKey: IZBOOUUHOXLUKB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • phosphoric acid (2-isobutylphenyl) diphenyl ester
  • [2-(2-methylpropyl)phenyl] diphenyl phosphate
  • diphenylisobutylphenylphosphate
  • 41120-99-4
  • Phosphoric acid, (2-methylpropyl)phenyl diphenyl ester

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
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0363 0.0524
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.1174 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0363 0.1036
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0363 0.0363
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0363 0.0524
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0363 0.0363
Entamoeba histolytica hypothetical protein 0.0036 0.2645 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.1174 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0363 0.0363
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0363 0.0524
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0363 0.0363
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0363 0.1036
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0363 0.0524
Trypanosoma cruzi DNA polymerase eta, putative 0.0019 0.1174 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.1174 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0363 0.0363
Schistosoma mansoni smad1 5 8 and 0.0008 0.0189 0.0539
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0363 0.0524
Loa Loa (eye worm) hypothetical protein 0.001 0.0363 0.0363
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.1174 0.1174
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0363 0.0524
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.1174 1
Brugia malayi MH2 domain containing protein 0.0008 0.0189 0.0189
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.1174 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0363 0.0363
Loa Loa (eye worm) Smad1 0.0008 0.0189 0.0189
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0363 0.0363
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0006 0 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.3506 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0363 0.0363
Brugia malayi nuclear receptor NHR-88 0.001 0.0363 0.0363
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.1174 1
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.1174 0.2969
Loa Loa (eye worm) hypothetical protein 0.001 0.0363 0.0363
Schistosoma mansoni thyroid hormone receptor 0.001 0.0363 0.1036
Schistosoma mansoni coup transcription factor 0.001 0.0363 0.1036
Echinococcus granulosus dna polymerase eta 0.0019 0.1174 0.2969
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.1174 0.1174
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0363 0.0363
Schistosoma mansoni smad1 5 8 and 0.0008 0.0189 0.0539
Schistosoma mansoni Smad4 0.0008 0.0189 0.0539
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.1174 0.1174
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0363 0.5
Loa Loa (eye worm) hypothetical protein 0.0019 0.1174 0.1174
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0189 0.0189
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0363 0.0363
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0363 0.0524
Brugia malayi nuclear hormone receptor 0.001 0.0363 0.0363
Schistosoma mansoni smad1 5 8 and 0.0008 0.0189 0.0539
Loa Loa (eye worm) hypothetical protein 0.001 0.0363 0.0363
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.3506 1
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.1174 0.3348
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0363 0.0363
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0363 0.0363
Loa Loa (eye worm) hypothetical protein 0.001 0.0363 0.0363
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0363 0.0363
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0363 0.1036
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0363 0.0524
Brugia malayi MH1 domain containing protein 0.0008 0.0189 0.0189
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0363 0.0524
Trypanosoma brucei unspecified product 0.0019 0.1174 1
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0363 0.0524
Giardia lamblia DINP protein human, muc B family 0.0019 0.1174 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0363 0.0363
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.1174 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0118 1 1
Entamoeba histolytica hypothetical protein 0.0036 0.2645 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0363 0.1036
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0363 0.0363
Plasmodium falciparum DNA repair protein REV1, putative 0.0006 0 0.5
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.1174 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0363 0.0524
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0645 0.55
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0363 0.0524
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0363 0.0524
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.1174 1
Schistosoma mansoni smad 0.0008 0.0189 0.0539
Plasmodium vivax DNA repair protein REV1, putative 0.0006 0 0.5
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0019 0.1174 0.5
Brugia malayi MH2 domain containing protein 0.0008 0.0189 0.0189
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.1174 0.3348
Brugia malayi MH1 domain containing protein 0.0008 0.0189 0.0189
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0363 0.1036
Loa Loa (eye worm) transcription factor SMAD2 0.0118 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.1174 1
Brugia malayi steroid hormone receptor 0.001 0.0363 0.0363
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.3506 0.3506
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.1174 0.2969
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0363 0.0363
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0645 0.55
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0363 0.5
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.1174 1
Entamoeba histolytica hypothetical protein 0.0036 0.2645 1
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0363 0.0363
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0363 0.0363
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0363 0.0363
Schistosoma mansoni nuclear hormone receptor 0.001 0.0363 0.1036
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.1174 1
Brugia malayi hypothetical protein 0.0036 0.2645 0.2645
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.1174 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0363 0.0363
Echinococcus multilocularis dna polymerase eta 0.0019 0.1174 0.2969
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.1174 1
Echinococcus granulosus FTZ F1 alpha 0.001 0.0363 0.0524
Leishmania major DNA polymerase kappa, putative 0.0019 0.1174 1
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0363 0.0524
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.3506 1
Echinococcus granulosus dna polymerase kappa 0.0019 0.1174 0.2969
Echinococcus multilocularis dna polymerase kappa 0.0019 0.1174 0.2969
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.3506 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.2645 0.7404
Schistosoma mansoni thyroid hormone receptor 0.001 0.0363 0.1036
Entamoeba histolytica hypothetical protein 0.0036 0.2645 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.3506 1
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0006 0 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.0363 0.0363
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0645 0.55
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0363 0.1036
Brugia malayi ecdysteroid receptor 0.001 0.0363 0.0363
Onchocerca volvulus 0.001 0.0363 0.5
Schistosoma mansoni DNA polymerase eta 0.0019 0.1174 0.3348
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0363 0.0524
Brugia malayi Smad1 0.0008 0.0189 0.0189
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0363 0.0524
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0363 0.5
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.2645 0.7544
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.1174 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0363 0.0363
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.3506 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.2645 0.7404
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.1174 1
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0006 0 0.5
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0363 0.0363
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0363 0.0524
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0363 0.1036
Trypanosoma brucei unspecified product 0.0013 0.0645 0.55
Loa Loa (eye worm) hypothetical protein 0.001 0.0363 0.0363
Trypanosoma brucei unspecified product 0.0013 0.0645 0.55
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0363 0.1036
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.1174 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.1174 1
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.1174 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0363 0.0363
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0363 0.0363
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0363 0.0363
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.3506 1
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0019 0.1174 0.5
Mycobacterium tuberculosis Conserved hypothetical protein 0.0019 0.1174 0.5
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0189 0.0189
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0189 0.0539
Trichomonas vaginalis DNA polymerase eta, putative 0.0019 0.1174 0.5
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.3506 0.3506
Loa Loa (eye worm) hypothetical protein 0.001 0.0363 0.0363
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.1174 1
Leishmania major DNA polymerase eta, putative 0.0019 0.1174 1
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0363 0.1036
Schistosoma mansoni hypothetical protein 0.0036 0.2645 0.7544
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.1174 1

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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