Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 9/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.37 |
| ▸ | PLK4 | O00444 | 2/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
| ▸ | MAPK3 | P27361 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28941142 | 0.86 | MAPK1 (0.46) | HDAC3HDAC1HDAC2HDAC6MAPK1 | |
| SCHEMBL29499535 | 0.85 | HDAC3 (0.43) | HDAC3HDAC1HDAC2HDAC6MAPK1 | |
| SCHEMBL28744836 | 0.83 | HDAC3 (0.45) | HDAC3HDAC1HDAC2HDAC6MAPK1 | |
| SCHEMBL29005059 | 0.82 | HDAC3 (0.44) | HDAC3HDAC1HDAC2HDAC6MAPK1 | |
| SCHEMBL28744916 | 0.81 | PLK4 (0.57) | HDAC3HDAC1HDAC2HDAC6MAPK1 | |
| SCHEMBL28744877 | 0.75 | MAPK1 (0.46) | HDAC3HDAC1HDAC2HDAC6MAPK1 | |
| SCHEMBL28744873 | 0.74 | MAPK11 (0.34) | MAPK14 | |
| SCHEMBL28744880 | 0.73 | MAPK1 (0.47) | HDAC3HDAC1HDAC2HDAC6MAPK1 | |
| SCHEMBL28744828 | 0.72 | MAPK1 (0.48) | HDAC3HDAC1HDAC2HDAC6MAPK1 | |
| SCHEMBL28744926 | 0.70 | PLK4 (0.51) | HDAC3HDAC1HDAC2HDAC6MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |