Detailed information for compound 1537568

Basic information

Technical information
  • TDR Targets ID: 1537568
  • Name: N-[(2-methoxyphenoxy)-methylphosphoryl]anilin e
  • MW: 277.256 | Formula: C14H16NO3P
  • H donors: 1 H acceptors: 1 LogP: 3.09 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccccc1OP(=O)(Nc1ccccc1)C
  • InChi: 1S/C14H16NO3P/c1-17-13-10-6-7-11-14(13)18-19(2,16)15-12-8-4-3-5-9-12/h3-11H,1-2H3,(H,15,16)
  • InChiKey: OMEIYWCDRZIRGQ-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • N-[(2-methoxyphenoxy)-methyl-phosphoryl]aniline
  • [(2-methoxyphenoxy)-methyl-phosphoryl]-phenyl-amine
  • BAS 00405168
  • Methylphosphonoamidate, o-(2-methoxyphenyl)-N-phenyl-
  • Oprea1_215371
  • ZINC00326133
  • ZINC00326135
  • MLS000718035
  • SMR000279603
  • Oprea1_306835

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 granulosus voltage dependent calcium channel subunit 0.0492 0.4165 0.4112
Brugia malayi Cache domain containing protein 0.0218 0.1625 1
Onchocerca volvulus 0.0052 0.0089 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 21 0.0052 0.0089 0.0549
Trypanosoma brucei calcium-activated potassium channel, putative 0.0052 0.0089 0.5
Mycobacterium tuberculosis Possible transmembrane cation transporter 0.0052 0.0089 0.5
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) uncoordinated protein 58 0.0052 0.0089 0.0089
Leishmania major hypothetical protein, conserved 0.0052 0.0089 0.5
Brugia malayi hypothetical protein 0.0052 0.0089 0.0549
Loa Loa (eye worm) TWK-28 protein 0.0052 0.0089 0.0089
Schistosoma mansoni twik family of potassium channels-related 0.0052 0.0089 0.0036
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Schistosoma mansoni calcium-activated potassium channel 0.0052 0.0089 0.0036
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 5 0.0052 0.0089 0.0549
Loa Loa (eye worm) hypothetical protein 0.014 0.0902 0.0902
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 13 0.0052 0.0089 0.0549
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 35 0.0052 0.0089 0.0549
Schistosoma mansoni dihydropyridine-sensitive l-type calcium channel 0.0238 0.1811 0.1766
Entamoeba histolytica calcium-gated potassium channel protein, putative 0.0052 0.0089 0.5
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) large conductance calcium-activated potassium channel alpha subunit ai 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Schistosoma mansoni biogenic amine (5HT) receptor 0.014 0.0902 0.0853
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Trypanosoma brucei calcium/potassium channel (CAKC), putative 0.0052 0.0089 0.5
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Trypanosoma cruzi hypothetical protein, conserved 0.0052 0.0089 0.5
Echinococcus granulosus biogenic amine 5HT receptor 0.014 0.0902 0.082
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Plasmodium vivax potassium channel, putative 0.0052 0.0089 0.5
Loa Loa (eye worm) hypothetical protein 0.0055 0.0114 0.0114
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 7 0.0052 0.0089 0.0549
Schistosoma mansoni hypothetical protein 0.0052 0.0089 0.0036
Schistosoma mansoni calcium-activated potassium channel 0.0052 0.0089 0.0036
Loa Loa (eye worm) hypothetical protein 0.014 0.0902 0.0902
Loa Loa (eye worm) potassium voltage-gated channel subfamily Q member 5 0.0052 0.0089 0.0089
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 19. C. elegans unc-58 ortholog 0.0052 0.0089 0.0549
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0535 0.4563 0.4563
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 24 0.0052 0.0089 0.0549
Echinococcus multilocularis voltage dependent calcium channel subunit 0.0492 0.4165 0.4112
Schistosoma mansoni twik family of potassium channels-related 0.0052 0.0089 0.0036
Schistosoma mansoni twik family of potassium channels-related 0.0052 0.0089 0.0036
Plasmodium vivax potassium channel, putative 0.0052 0.0089 0.5
Plasmodium falciparum potassium channel 0.0052 0.0089 0.5
Loa Loa (eye worm) hypothetical protein 0.1121 1 1
Mycobacterium ulcerans transmembrane cation transporter 0.0052 0.0089 0.5
Schistosoma mansoni hypothetical protein 0.1121 1 1
Echinococcus multilocularis voltage dependent calcium channel subunit 0.1081 0.9627 0.9624
Mycobacterium ulcerans ion transport protein 0.0052 0.0089 0.5
Schistosoma mansoni twik family of potassium channels-related 0.0052 0.0089 0.0036
Echinococcus multilocularis serotonin receptor 0.014 0.0902 0.082
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0052 0.0089 0.5
Echinococcus granulosus metabotropic glutamate receptor 5 0.0052 0.0091 0.0002
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0052 0.0089 0.5
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Trypanosoma cruzi ion transport protein, putative 0.0052 0.0089 0.5
Schistosoma mansoni twik family of potassium channels-related 0.0052 0.0089 0.0036
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 38. C. elegans sup-9 ortholog 0.0052 0.0089 0.0549
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 45 0.0052 0.0089 0.0549
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Leishmania major potassium channel subunit-like protein 0.0052 0.0089 0.5
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Onchocerca volvulus 0.0052 0.0089 0.5
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.048 0.4055 0.4055
Brugia malayi hypothetical protein 0.0052 0.0089 0.0549
Leishmania major calcium/potassium channel (CAKC), putative 0.0052 0.0089 0.5
Leishmania major hypothetical protein, conserved 0.0052 0.0089 0.5
Loa Loa (eye worm) S-phase kinase-associated protein 1A 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Leishmania major ion transport protein-like protein 0.0052 0.0089 0.5
Loa Loa (eye worm) TWK-7 protein 0.0052 0.0089 0.0089
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0052 0.0089 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 12 0.0052 0.0089 0.0549
Echinococcus granulosus voltage dependent calcium channel subunit 0.1081 0.9627 0.9624
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0052 0.0089 0.5
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0052 0.0091 0.0002
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Schistosoma mansoni calcium-activated potassium channel 0.1121 1 1
Schistosoma mansoni amine GPCR 0.0359 0.2934 0.2896
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Schistosoma mansoni twik family of potassium channels-related 0.0052 0.0089 0.0036
Loa Loa (eye worm) hypothetical protein 0.0218 0.1625 0.1625
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0052 0.0089 0.5
Onchocerca volvulus 0.0052 0.0089 0.5
Onchocerca volvulus 0.0052 0.0089 0.5
Schistosoma mansoni hypothetical protein 0.0254 0.1961 0.1917
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0052 0.0089 0.5
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Schistosoma mansoni twik family of potassium channels-related 0.0052 0.0089 0.0036
Schistosoma mansoni twik family of potassium channels-related 0.0052 0.0089 0.0036
Toxoplasma gondii ion channel protein 0.0052 0.0089 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0052 0.0089 0.5
Giardia lamblia Hypothetical protein 0.0052 0.0089 0.5
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 32 0.0052 0.0089 0.0549
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 30. 0.0052 0.0089 0.0549
Schistosoma mansoni dihydropyridine-sensitive l-type calcium channel 0.0472 0.3978 0.3946
Loa Loa (eye worm) hypothetical protein 0.0052 0.0091 0.0091
Onchocerca volvulus 0.0052 0.0089 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 28 0.0052 0.0089 0.0549
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Trypanosoma cruzi ion transport protein, putative 0.0052 0.0089 0.5
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0052 0.0089 0.5
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0052 0.0089 0.5
Onchocerca volvulus 0.0052 0.0089 0.5
Brugia malayi Twik (KCNK-like) family of potasium channels, alpha subunit 40 0.0052 0.0089 0.0549
Echinococcus multilocularis small conductance calcium activated potassium 0.1121 1 1
Echinococcus multilocularis serotonin receptor 0.014 0.0902 0.082
Toxoplasma gondii ion channel protein 0.0052 0.0089 0.5
Onchocerca volvulus 0.0052 0.0089 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39B 0.0052 0.0089 0.0549
Schistosoma mansoni calcium-activated potassium channel 0.1015 0.9011 0.9006
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39A 0.0052 0.0089 0.0549
Loa Loa (eye worm) hypothetical protein 0.0052 0.0089 0.0089
Plasmodium falciparum potassium channel 0.0052 0.0089 0.5
Onchocerca volvulus 0.0052 0.0089 0.5
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0052 0.0089 0.5
Schistosoma mansoni serine-rich repeat protein 0.0254 0.1961 0.1917
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 17 0.0052 0.0089 0.0549

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] 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.
 
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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