Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR6 | P51684 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | PRKACA | P17612 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.38 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29226411 | 1.00 | CCR6 (0.46) | CCR6KCNH2CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL30927950 | 1.00 | CCR6 (0.46) | CCR6KCNH2CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL30927951 | 0.86 | CYP19A1 (0.41) | CCR6KCNH2CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL29226459 | 0.86 | CYP19A1 (0.41) | CCR6KCNH2CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL29226463 | 0.86 | CYP19A1 (0.41) | CCR6KCNH2CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL29226403 | 0.83 | CYP19A1 (0.56) | CYP19A1CYP3A4AOC3CYP17A1MAPT | |
| SCHEMBL29226402 | 0.83 | CYP19A1 (0.56) | CYP19A1CYP3A4AOC3CYP17A1MAPT | |
| SCHEMBL7128923 | 0.82 | CA1 (0.55) | AOC3MAPTHSD11B1 | |
| SCHEMBL29226394 | 0.79 | SMN1; SMN2 (0.48) | CYP19A1CYP3A4CYP1A2CYP2C9AOC3 | |
| SCHEMBL29226395 | 0.79 | SMN1; SMN2 (0.48) | CYP19A1CYP3A4CYP1A2CYP2C9AOC3 |
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-117924156-A | Synthesis method of aza-aryl alcohol compound and chiral alpha-hydroxycarboxylic acid | 赣南师范大学 | 2024-04-26 | — | — | CN | disclosed |