Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ICMT | O60725 | 1/20 | 0.38 |
| ▸ | SSTR4 | P31391 | 3/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | CASR | P41180 | 5/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7871934 | 0.85 | ACP3 (0.44) | ALDH1A1CYP1A2CYP2C9CYP2C19SSTR4 | |
| SCHEMBL6248166 | 0.71 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2C9CYP2C19AOC3 | |
| SCHEMBL11672371 | 0.71 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2C9CYP2C19AOC3 | |
| SCHEMBL29239393 | 0.71 | FAAH (0.43) | CYP2C19 | |
| SCHEMBL25156662 | 0.71 | ICMT (0.43) | ALDH1A1CYP1A2CYP2C9CYP2C19ICMT | |
| SCHEMBL31359920 | 0.71 | ICMT (0.43) | ALDH1A1CYP1A2CYP2C9CYP2C19ICMT | |
| SCHEMBL10416031 | 0.70 | ALDH1A1 (0.52) | ALDH1A1CYP1A2CYP2C9CYP2C19AOC3 | |
| SCHEMBL908326 | 0.70 | POLB (0.40) | SSTR4HSD11B1 | |
| Tetrahydrofuran SCHEMBL971565 | 0.69 | CYP1A2 (0.43) | ALDH1A1CYP1A2CYP2C9CYP2C19SSTR4 | |
| SCHEMBL15669160 | 0.69 | ALDH1A1 (0.50) | ALDH1A1CYP1A2CYP2C9CYP2C19AOC3 |
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-113717033-B | Benzyl ether compound and synthesis method thereof | 嘉兴学院 | 2024-03-15 | — | — | CN | disclosed |
| CN-113717033-A | Benzyl ether compound and synthesis method thereof | 嘉兴学院 | 2021-11-30 | — | — | CN | disclosed |