Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.76 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.76 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.76 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.76 |
| ▸ | AR | P10275 | 1/20 | 0.76 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.76 |
| ▸ | NPC1 | O15118 | 2/20 | 0.65 |
| ▸ | RAB9A | P51151 | 2/20 | 0.65 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.57 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.57 |
| ▸ | PPARA | Q07869 | 3/20 | 0.55 |
| ▸ | PPARG | P37231 | 1/20 | 0.55 |
| ▸ | PPARD | Q03181 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Eugenol SCHEMBL30183866 | 1.00 | ALDH1A1 (0.76) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL27608718 | 0.89 | ALDH1A1 (0.85) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL29943804 | 0.89 | ALDH1A1 (0.85) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL114133 | 0.89 | ALDH1A1 (0.85) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL31593688 | 0.88 | ALDH1A1 (0.78) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL16433004 | 0.87 | ALDH1A1 (0.82) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL31189370 | 0.87 | ALDH1A1 (0.82) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL6152218 | 0.87 | ALDH1A1 (0.82) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL27710638 | 0.87 | ALDH1A1 (0.82) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL28883151 | 0.87 | ALDH1A1 (0.93) | ALDH1A1ALOX5PTGS1CYP3A4AR |
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 |
|---|---|---|---|---|---|---|---|
| CN-115785036-A | Diolefin compound containing furan structure and preparation method thereof | 中国科学技术大学 | 2023-03-14 | — | — | CN | disclosed |