Detailed information for compound 1445376

Basic information

Technical information
  • TDR Targets ID: 1445376
  • Name: 2,4-di(phenyl)-N-(1-phenylethyl)-1,3-oxazol-5 -amine
  • MW: 340.418 | Formula: C23H20N2O
  • H donors: 1 H acceptors: 1 LogP: 5.87 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(c1ccccc1)Nc1oc(nc1c1ccccc1)c1ccccc1
  • InChi: 1S/C23H20N2O/c1-17(18-11-5-2-6-12-18)24-23-21(19-13-7-3-8-14-19)25-22(26-23)20-15-9-4-10-16-20/h2-17,24H,1H3
  • InChiKey: KQYCMTHDFZXIDG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2,4-di(phenyl)-N-(1-phenylethyl)oxazol-5-amine
  • 2,4-di(phenyl)-N-(1-phenylethyl)-5-oxazolamine
  • [2,4-di(phenyl)oxazol-5-yl]-(1-phenylethyl)amine

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens survival of motor neuron 2, centromeric Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Brugia malayi hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus granulosus survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
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 fatty acid desaturase 0.0092 0.0128 1
Trypanosoma brucei cytochrome b5-dependent oleate desaturase 0.0092 0.0128 0.0128
Mycobacterium ulcerans linoleoyl-CoA desaturase, DesA3_2 0.0092 0.0128 0.5
Echinococcus multilocularis survival motor neuron protein 1 0.0286 0.2493 1
Trypanosoma brucei delta-6 fatty acid desaturase, putative 0.0092 0.0128 0.0128
Trypanosoma cruzi fatty acid desaturase, putative 0.0809 0.8881 0.8867
Loa Loa (eye worm) hypothetical protein 0.0286 0.2493 0.2702
Brugia malayi acyl-CoA desaturase 0.0809 0.8881 1
Toxoplasma gondii sphingolipid delta 4 desaturase/c-4 hydroxylase protein des2 family protein 0.0092 0.0128 0.5
Leishmania major fatty-acid desaturase, putative 0.0901 1 1
Loa Loa (eye worm) acyl-CoA desaturase 0.0809 0.8881 1
Plasmodium vivax stearoyl-CoA desaturase (acyl-CoA desaturase, faty acid desaturase), putative 0.0809 0.8881 0.5
Onchocerca volvulus 0.0901 1 1
Mycobacterium tuberculosis Probable conserved membrane protein 0.0092 0.0128 0.5
Mycobacterium tuberculosis Probable transmembrane alkane 1-monooxygenase AlkB (alkane 1-hydroxylase) (lauric acid omega-hydroxylase) (omega-hydroxylase) (f 0.0092 0.0128 0.5
Trypanosoma brucei sphingolipid delta 4 desaturase, putative 0.0092 0.0128 0.0128
Mycobacterium ulcerans hypothetical protein 0.0092 0.0128 0.5
Trypanosoma brucei fatty acid desaturase, putative 0.0901 1 1
Mycobacterium ulcerans electron transfer protein FdxB 0.0092 0.0128 0.5
Trypanosoma brucei delta-4 fatty acid desaturase 0.0092 0.0128 0.0128
Onchocerca volvulus 0.0901 1 1
Brugia malayi hypothetical protein 0.0286 0.2493 0.2702
Mycobacterium tuberculosis Possible electron transfer protein FdxB 0.0092 0.0128 0.5
Mycobacterium ulcerans hypothetical protein 0.0092 0.0128 0.5
Trypanosoma cruzi fatty acid desaturase, putative 0.0809 0.8881 0.8867
Echinococcus granulosus survival motor neuron protein 1 0.0286 0.2493 1
Mycobacterium ulcerans linoleoyl-CoA desaturase, DesA3 0.0092 0.0128 0.5
Mycobacterium ulcerans transmembrane alkane 1-monooxygenase AlkB 0.0092 0.0128 0.5
Plasmodium falciparum stearoyl-CoA desaturase 0.0809 0.8881 0.5
Mycobacterium ulcerans linoleoyl-CoA desaturase, DesA3 0.0092 0.0128 0.5
Trypanosoma cruzi fatty acid desaturase, putative 0.0901 1 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.0891 um PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: Inhibitors of the vitamin D receptor (VDR): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504855] 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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