Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | LPL | P06858 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25811694 | 0.77 | PTGS2 (0.36) | TRPA1SMN1; SMN2MAPTHTTCYP1A2 | |
| SCHEMBL4798301 | 0.73 | TRPA1 (0.46) | TRPA1SMN1; SMN2MAPTCYP1A2CYP2A6 | |
| SCHEMBL1438878 | 0.72 | TRPA1 (0.64) | TRPA1SMN1; SMN2MAPTHTTALDH1A1 | |
| SCHEMBL12658938 | 0.70 | TRPA1 (0.43) | TRPA1SMN1; SMN2MAPTHTTCYP1A2 | |
| SCHEMBL10257025 | 0.70 | HPGD (0.43) | TRPA1SMN1; SMN2MAPTCYP1A2CYP2A6 | |
| SCHEMBL10208289 | 0.68 | TRPA1 (0.64) | TRPA1SMN1; SMN2MAPTCYP1A2CYP2A6 | |
| SCHEMBL13772811 | 0.68 | TRPA1 (0.41) | TRPA1SMN1; SMN2MAPTHTTCYP1A2 | |
| SCHEMBL1063295 | 0.68 | SKP2 (0.42) | TRPA1SMN1; SMN2MAPTCYP1A2CYP2A6 | |
| SCHEMBL12188730 | 0.68 | ABL1 (0.43) | TRPA1SMN1; SMN2MAPTHTTCYP1A2 | |
| SCHEMBL29923559 | 0.68 | SKP2 (0.42) | TRPA1SMN1; SMN2MAPTCYP1A2CYP2A6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004085408-A1 | 2, 3, 6-TRISUBSTITUTED-4-PYRIMIDONE DERIVATIVES | MITSUBISHI PHARMA CORPORATION (JP) | 2004-10-07 | — | — | WO | disclosed |