Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 7/20 | 0.50 |
| ▸ | WNT3A | P56704 | 7/20 | 0.50 |
| ▸ | METAP2 | P50579 | 1/20 | 0.49 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | AKT1 | P31749 | 2/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CLK2 | P49760 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21441283 | 0.89 | CTNNB1 (0.50) | CTNNB1WNT3AMETAP2S1PR1TRPA1 | |
| SCHEMBL21441341 | 0.85 | CLK1 (0.51) | CTNNB1WNT3AMETAP2NPC1RAB9A | |
| SCHEMBL21441367 | 0.85 | CTNNB1 (0.67) | CTNNB1WNT3AMETAP2NPC1RAB9A | |
| SCHEMBL21441262 | 0.83 | CTNNB1 (0.66) | CTNNB1WNT3ANPC1RAB9AROCK2 | |
| SCHEMBL21441263 | 0.82 | CTNNB1 (0.67) | CTNNB1WNT3AMETAP2RAB9ATRPA1 | |
| SCHEMBL21441313 | 0.82 | CTNNB1 (0.69) | CTNNB1WNT3ATRPA1TRPM8 | |
| SCHEMBL15980143 | 0.82 | CTNNB1 (0.74) | CTNNB1WNT3AMETAP2S1PR1NPC1 | |
| SCHEMBL21441407 | 0.80 | CTNNB1 (0.50) | CTNNB1WNT3AMETAP2NPC1RAB9A | |
| SCHEMBL21441337 | 0.79 | ROCK2 (0.56) | CTNNB1WNT3ANPC1RAB9ATRPA1 | |
| SCHEMBL21441403 | 0.78 | CTNNB1 (0.49) | CTNNB1WNT3AMETAP2NPC1RAB9A |
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 |