Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.70 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.70 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.70 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.70 |
| ▸ | AR | P10275 | 1/20 | 0.70 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.70 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.53 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.53 |
| ▸ | PPARA | Q07869 | 4/20 | 0.51 |
| ▸ | PPARG | P37231 | 2/20 | 0.51 |
| ▸ | PPARD | Q03181 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
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 SCHEMBL9392613 | 0.89 | ALDH1A1 (0.88) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| SCHEMBL2554889 | 0.89 | ALDH1A1 (0.63) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| SCHEMBL29368253 | 0.89 | ALDH1A1 (0.63) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL27608718 | 0.85 | ALDH1A1 (0.85) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL29943804 | 0.85 | ALDH1A1 (0.85) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL114133 | 0.85 | ALDH1A1 (0.85) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL4652636 | 0.85 | ALDH1A1 (0.70) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL31593688 | 0.84 | ALDH1A1 (0.78) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL6152218 | 0.84 | ALDH1A1 (0.82) | ALDH1A1ALOX5PTGS1CYP3A4AR | |
| Eugenol SCHEMBL31189370 | 0.84 | ALDH1A1 (0.82) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118045082-A | Methods and compositions for soft anticholinergic esters | 博多尔实验仪器公司 | 2024-05-17 | — | — | CN | disclosed |
| CN-118021797-A | Methods and compositions for soft anticholinergic esters | 博多尔实验仪器公司 | 2024-05-14 | — | — | CN | disclosed |