Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 1.00 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | HPGD | P15428 | 2/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.67 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.67 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.67 |
| ▸ | ABAT | P80404 | 1/20 | 0.67 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.67 |
| ▸ | TYR | P14679 | 2/20 | 0.65 |
| ▸ | TTR | P02766 | 1/20 | 0.62 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.61 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.59 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.59 |
| ▸ | STAT3 | P40763 | 2/20 | 0.59 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.59 |
| ▸ | RELA | Q04206 | 2/20 | 0.59 |
| ▸ | XDH | P47989 | 1/20 | 0.59 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29452839 | 1.00 | TRPA1 (1.00) | TRPA1ALDH1A1HPGDTDP1TRIM24 | |
| SCHEMBL54199 | 1.00 | TRPA1 (1.00) | TRPA1ALDH1A1HPGDTDP1TRIM24 | |
| Methyl Alcohol SCHEMBL27907460 | 0.98 | TRPA1 (0.96) | TRPA1ALDH1A1HPGDTDP1TRIM24 | |
| SCHEMBL170629 | 0.93 | TRPA1 (0.86) | TRPA1ALDH1A1HPGDTDP1TRIM24 | |
| Ethylene Glycol SCHEMBL3792165 | 0.93 | TRPA1 (0.86) | TRPA1ALDH1A1HPGDTDP1TRIM24 | |
| Guaiacol SCHEMBL26117966 | 0.91 | TRPA1 (0.83) | TRPA1ALDH1A1HPGDTDP1TRIM24 | |
| Sulfuric Acid SCHEMBL19742909 | 0.91 | TRPA1 (0.83) | TRPA1ALDH1A1HPGDTDP1TRIM24 | |
| Phenol SCHEMBL27649594 | 0.90 | TRPA1 (0.81) | TRPA1ALDH1A1HPGDTDP1TRIM24 | |
| SCHEMBL29003595 | 0.88 | TRPA1 (0.78) | TRPA1ALDH1A1HPGDTDP1TRIM24 | |
| SCHEMBL6246403 | 0.87 | TRPA1 (0.76) | TRPA1ALDH1A1HPGDTDP1TRIM24 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2621462-A1 | ORAL CARE COMPOSITIONS WITH IMPROVED FLAVOR | The Procter and Gamble Company (US) | 2013-08-07 | — | — | EP | disclosed |
| WO-2012044728-A1 | ORAL CARE COMPOSITIONS WITH IMPROVED FLAVOR | THE PROCTER & GAMBLE COMPANY (US) | 2012-04-05 | — | — | WO | disclosed |