Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 3/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CSF1R | P07333 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20558340 | 0.89 | CYP1A2 (0.33) | CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1 | |
| SCHEMBL29457643 | 0.89 | CYP1A2 (0.33) | CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1 | |
| SCHEMBL20607620 | 0.88 | POLB (0.33) | CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1 | |
| SCHEMBL29551202 | 0.88 | POLB (0.33) | CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1 | |
| SCHEMBL16915402 | 0.88 | L3MBTL1 (0.32) | CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1 | |
| SCHEMBL29780129 | 0.88 | L3MBTL1 (0.32) | CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1 | |
| SCHEMBL22115464 | 0.87 | KEAP1 (0.39) | CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1 | |
| SCHEMBL29465212 | 0.87 | KEAP1 (0.39) | CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1 | |
| SCHEMBL22691623 | 0.84 | CTSA (0.33) | CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1 | |
| SCHEMBL16915390 | 0.81 | PSEN1 (0.36) | CYP1A2CYP3A4CYP2C19CYP2D6MEN1 |
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-2021113284-A1 | PROCESS FOR SYNTHESIS OF A 2-(5-ISOXAZOLYL)-PHENOL | FMC CORPORATION (US) | 2021-06-10 | — | — | WO | disclosed |