Detailed information for compound 839709

Basic information

Technical information
  • TDR Targets ID: 839709
  • Name: 4-methoxy-6-(phenoxy)pyrimidin-2-amine
  • MW: 217.224 | Formula: C11H11N3O2
  • H donors: 1 H acceptors: 2 LogP: 2.02 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc(Oc2ccccc2)nc(n1)N
  • InChi: 1S/C11H11N3O2/c1-15-9-7-10(14-11(12)13-9)16-8-5-3-2-4-6-8/h2-7H,1H3,(H2,12,13,14)
  • InChiKey: IIOJVHHQYGRCRP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-methoxy-6-(phenoxy)-2-pyrimidinamine
  • [4-methoxy-6-(phenoxy)pyrimidin-2-yl]amine
  • A1681/0071774
  • 4-methoxy-6-phenoxypyrimidin-2-amine
  • MLS001143862
  • SMR000473301
  • CBMicro_019084
  • AG-670/25003527
  • ZINC00051728
  • Oprea1_179103
  • EU-0001746
  • BIM-0018965.P001
  • Oprea1_733537

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
Brugia malayi hypothetical protein 0.0073 0 0.5
Trypanosoma brucei calcium-activated potassium channel, putative 0.0073 0 0.5
Leishmania major calcium/potassium channel (CAKC), putative 0.0073 0 0.5
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0121 0.0223 0.7795
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0121 0.0223 0.7795
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 38. C. elegans sup-9 ortholog 0.0073 0 0.5
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0073 0 0.5
Trypanosoma cruzi ion transport protein, putative 0.0073 0 0.5
Mycobacterium tuberculosis Probable dehydrogenase 0.0121 0.0223 0.7795
Giardia lamblia Hypothetical protein 0.0073 0 0.5
Onchocerca volvulus 0.0073 0 0.5
Loa Loa (eye worm) hypothetical protein 0.071 0.2985 0.2985
Mycobacterium ulcerans ion transport protein 0.0073 0 0.5
Plasmodium vivax potassium channel, putative 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 45 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 21 0.0073 0 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 12 0.0073 0 0.5
Schistosoma mansoni hypothetical protein 0.2207 1 1
Plasmodium falciparum potassium channel 0.0073 0 0.5
Leishmania major hypothetical protein, conserved 0.0073 0 0.5
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0134 0.0286 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0134 0.0286 1
Onchocerca volvulus 0.0073 0 0.5
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0073 0 0.5
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0073 0 0.5
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0906 0.3905 0.3905
Schistosoma mansoni calcium-activated potassium channel 0.2207 1 1
Toxoplasma gondii ion channel protein 0.0073 0 0.5
Onchocerca volvulus 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potasium channels, alpha subunit 40 0.0073 0 0.5
Echinococcus multilocularis small conductance calcium activated potassium 0.2207 1 1
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 32 0.0073 0 0.5
Onchocerca volvulus 0.0073 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0751 0.3175 0.3175
Brugia malayi hypothetical protein 0.0073 0 0.5
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0073 0 0.5
Plasmodium falciparum potassium channel 0.0073 0 0.5
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0121 0.0223 0.7795
Leishmania major potassium channel subunit-like protein 0.0073 0 0.5
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0073 0 0.5
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0073 0 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0073 0 0.5
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0121 0.0223 0.7795
Loa Loa (eye worm) hypothetical protein 0.0674 0.2814 0.2814
Leishmania major hypothetical protein, conserved 0.0073 0 0.5
Onchocerca volvulus 0.0073 0 0.5
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0134 0.0286 1
Leishmania major ion transport protein-like protein 0.0073 0 0.5
Trypanosoma cruzi ion transport protein, putative 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 7 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 28 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 5 0.0073 0 0.5
Trypanosoma brucei calcium/potassium channel (CAKC), putative 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39B 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 13 0.0073 0 0.5
Mycobacterium ulcerans transmembrane cation transporter 0.0073 0 0.5
Entamoeba histolytica calcium-gated potassium channel protein, putative 0.0073 0 0.5
Onchocerca volvulus 0.0073 0 0.5
Schistosoma mansoni calcium-activated potassium channel 0.1424 0.6331 0.6331
Mycobacterium tuberculosis Probable reductase 0.0121 0.0223 0.7795
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 17 0.0073 0 0.5
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0073 0 0.5
Plasmodium vivax potassium channel, putative 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 19. C. elegans unc-58 ortholog 0.0073 0 0.5
Toxoplasma gondii ion channel protein 0.0073 0 0.5
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39A 0.0073 0 0.5
Onchocerca volvulus 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 30. 0.0073 0 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 35 0.0073 0 0.5
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0134 0.0286 1
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 24 0.0073 0 0.5
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0073 0 0.5
Onchocerca volvulus 0.0073 0 0.5
Loa Loa (eye worm) hypothetical protein 0.2207 1 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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

Bibliographic References

No literature references available for this target.

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