Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 19/20 | 0.81 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.70 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.70 |
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 | |
|---|---|---|---|---|
| SCHEMBL28906572 | 1.00 | KRAS (0.81) | KRASMAPK3MAPK1 | |
| SCHEMBL25137026 | 1.00 | KRAS (0.81) | KRASMAPK3MAPK1 | |
| SCHEMBL28906566 | 0.94 | KRAS (0.82) | KRASMAPK3MAPK1 | |
| SCHEMBL30047390 | 0.93 | KRAS (0.79) | KRASMAPK3MAPK1 | |
| SCHEMBL28906505 | 0.93 | KRAS (0.79) | KRASMAPK3MAPK1 | |
| SCHEMBL28906536 | 0.93 | KRAS (0.69) | KRASMAPK3MAPK1 | |
| SCHEMBL25136891 | 0.91 | KRAS (0.78) | KRASMAPK3MAPK1 | |
| SCHEMBL24761650 | 0.90 | KRAS (0.84) | KRASMAPK3MAPK1 | |
| SCHEMBL23053261 | 0.89 | KRAS (1.00) | KRAS | |
| SCHEMBL30249833 | 0.89 | KRAS (1.00) | KRAS |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023061463-A1 | NOVEL PYRIMIDOPYRIDINE COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF | 广东东阳光药业有限公司 | 2023-04-20 | — | — | WO | disclosed |