Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK4 | O00444 | 2/20 | 0.48 |
| ▸ | ULK1 | O75385 | 6/20 | 0.48 |
| ▸ | ULK2 | Q8IYT8 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.45 |
| ▸ | MAPK3 | P27361 | 2/20 | 0.45 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.41 |
| ▸ | CDK2 | P24941 | 2/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | IDH1 | O75874 | 1/20 | 0.37 |
| ▸ | IDH2 | P48735 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28744911 | 1.00 | PLK4 (0.48) | PLK4ULK1ULK2MAPK1MAPK3 | |
| SCHEMBL28941142 | 0.84 | MAPK1 (0.46) | ULK1MAPK1MAPK3CCNE1CDK2 | |
| SCHEMBL28744926 | 0.83 | PLK4 (0.51) | PLK4MAPK1MAPK3CCNE1CDK2 | |
| SCHEMBL29499595 | 0.83 | PLK4 (0.51) | PLK4MAPK1MAPK3CCNE1CDK2 | |
| SCHEMBL29499565 | 0.78 | ULK1 (0.48) | ULK1ULK2MAPK1MAPK3CCNE1 | |
| SCHEMBL28744859 | 0.78 | ULK1 (0.48) | ULK1ULK2MAPK1MAPK3CCNE1 | |
| SCHEMBL18765976 | 0.74 | MAPK1 (0.57) | ULK1ULK2MAPK1MAPK3CCNE1 | |
| SCHEMBL29499572 | 0.67 | MAPK1 (0.56) | PLK4ULK1ULK2MAPK1MAPK3 | |
| SCHEMBL28744841 | 0.67 | MAPK1 (0.56) | PLK4ULK1ULK2MAPK1MAPK3 | |
| SCHEMBL29499586 | 0.66 | MAPK1 (0.50) | PLK4MAPK1MAPK3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114276331-B | 4-aminopiperidine compound and preparation method, pharmaceutical composition and application thereof | 中国药科大学 | 2023-05-23 | — | — | CN | disclosed |
| CN-114276331-A | 4-aminopiperidine compound and preparation method, pharmaceutical composition and application thereof | 中国药科大学 | 2022-04-05 | — | — | CN | disclosed |