Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 20/20 | 0.45 |
| ▸ | AKT1 | P31749 | 14/20 | 0.45 |
| ▸ | MTOR | P42345 | 11/20 | 0.45 |
| ▸ | MAP3K12 | Q12852 | 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 | |
|---|---|---|---|---|
| SCHEMBL2396415 | 0.75 | PIK3CA (0.45) | PIK3CAAKT1MTORMAP3K12 | |
| SCHEMBL1497747 | 0.75 | PIK3CA (0.51) | PIK3CAAKT1MTORMAP3K12 | |
| SCHEMBL1497744 | 0.75 | PIK3CA (0.51) | PIK3CAAKT1MTORMAP3K12 | |
| SCHEMBL2399183 | 0.73 | PIK3CA (0.45) | PIK3CAAKT1MTORMAP3K12 | |
| SCHEMBL1497566 | 0.72 | PIK3CA (0.44) | PIK3CAAKT1MTORMAP3K12 | |
| SCHEMBL1497705 | 0.72 | PIK3CA (0.45) | PIK3CAAKT1MTORMAP3K12 | |
| SCHEMBL1497707 | 0.72 | PIK3CA (0.45) | PIK3CAAKT1MTORMAP3K12 | |
| SCHEMBL1309681 | 0.71 | PIK3CA (0.71) | PIK3CAAKT1MTORMAP3K12 | |
| SCHEMBL1497596 | 0.70 | PIK3CA (0.45) | PIK3CAAKT1MTORMAP3K12 | |
| SCHEMBL2397736 | 0.70 | PIK3CA (0.46) | PIK3CAAKT1MTORMAP3K12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2475375-A2 | PI3 KINASE INHIBITORS AND USES THEREOF | Avila Therapeutics, Inc. (US) | 2012-07-18 | — | — | EP | disclosed |
| WO-2011031896-A2 | PI3 KINASE INHIBITORS AND USES THEREOF | AVILA THERAPEUTICS, INC. (US) | 2011-03-17 | — | — | WO | disclosed |