Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 17/20 | 0.49 |
| ▸ | PIK3R1 | P27986 | 14/20 | 0.49 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2378304 | 0.89 | PIK3CA (0.54) | PIK3CAPIK3R1PIK3CB | |
| SCHEMBL2377669 | 0.88 | PIK3CA (0.55) | PIK3CAPIK3R1PIK3CB | |
| SCHEMBL2375834 | 0.87 | PIK3CA (0.53) | PIK3CAPIK3R1PIK3CB | |
| SCHEMBL2377781 | 0.87 | PIK3CA (0.48) | PIK3CAPIK3R1GAA | |
| SCHEMBL2377033 | 0.87 | PIK3CA (0.50) | PIK3CAPIK3R1PIK3CB | |
| SCHEMBL12247852 | 0.87 | PIK3R1 (0.52) | PIK3CAPIK3R1PIK3CB | |
| SCHEMBL2379277 | 0.86 | PIK3CA (0.51) | PIK3CAPIK3R1PIK3CB | |
| SCHEMBL2377408 | 0.86 | PIK3CA (0.49) | PIK3CAPIK3R1PIK3CBALDH1A1 | |
| SCHEMBL2377992 | 0.86 | PIK3CA (0.53) | PIK3CAPIK3R1PIK3CB | |
| SCHEMBL2377537 | 0.86 | PIK3CA (0.53) | PIK3CAPIK3R1PIK3CB |
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 |
|---|---|---|---|---|---|---|---|
| US-8022205-B2 | Pyrimidine derivatives as PI3K inhibitor and use thereof | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2011-09-20 | — | — | US | disclosed |