Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 7/20 | 0.56 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.56 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.56 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.56 |
| ▸ | CLK2 | P49760 | 1/20 | 0.56 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.56 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.56 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.56 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.56 |
| ▸ | CTNNB1 | P35222 | 7/20 | 0.55 |
| ▸ | WNT3A | P56704 | 7/20 | 0.55 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.42 |
| ▸ | CDC7 | O00311 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21441367 | 0.88 | CTNNB1 (0.67) | ROCK2ROCK1NPC1RAB9ADYRK3 | |
| SCHEMBL21441262 | 0.86 | CTNNB1 (0.66) | ROCK2ROCK1NPC1RAB9ADYRK3 | |
| SCHEMBL21441417 | 0.84 | CTNNB1 (0.55) | ROCK2NPC1RAB9ACTNNB1WNT3A | |
| SCHEMBL15980140 | 0.84 | CTNNB1 (0.78) | ROCK2ROCK1NPC1RAB9ADYRK3 | |
| SCHEMBL21441283 | 0.84 | CTNNB1 (0.50) | ROCK2CTNNB1WNT3ACDC7TRPA1 | |
| SCHEMBL21441401 | 0.82 | CTNNB1 (0.53) | ROCK2ROCK1NPC1RAB9ADYRK3 | |
| SCHEMBL21441365 | 0.80 | CTNNB1 (0.54) | ROCK2ROCK1NPC1RAB9ADYRK3 | |
| SCHEMBL21441407 | 0.80 | CTNNB1 (0.50) | ROCK2ROCK1NPC1RAB9ADYRK3 | |
| SCHEMBL21441341 | 0.80 | CLK1 (0.51) | ROCK2ROCK1NPC1RAB9ADYRK3 | |
| SCHEMBL21441263 | 0.80 | CTNNB1 (0.67) | ROCK2ROCK1RAB9ACSNK2A1CTNNB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3206686-B1 | GAMMA-DIKETONES FOR TREATMENT AND PREVENTION OF AGING SKIN AND WRINKLES | SAMUMED LLC (US) | 2019-10-09 | — | — | EP | disclosed |