Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 17/20 | 0.67 |
| ▸ | HDAC1 | Q13547 | 12/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 11/20 | 0.56 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.49 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.49 |
| ▸ | MET | P08581 | 1/20 | 0.49 |
| ▸ | PIM1 | P11309 | 1/20 | 0.49 |
| ▸ | LTK | P29376 | 1/20 | 0.49 |
| ▸ | GRK5 | P34947 | 1/20 | 0.49 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.49 |
| ▸ | CDK8 | P49336 | 1/20 | 0.49 |
| ▸ | NEK2 | P51955 | 1/20 | 0.49 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.49 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.49 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.49 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.49 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL30474676 | 0.89 | HDAC2 (0.61) | HDAC2HDAC1HDAC3CHEK1NTRK1 | |
| SCHEMBL25216647 | 0.89 | HDAC2 (0.61) | HDAC2HDAC1HDAC3CHEK1NTRK1 | |
| SCHEMBL25244474 | 0.89 | HDAC2 (0.61) | HDAC2HDAC1HDAC3CHEK1NTRK1 | |
| SCHEMBL25219240 | 0.89 | HDAC2 (0.61) | HDAC2HDAC1HDAC3CHEK1NTRK1 | |
| SCHEMBL31108970 | 0.89 | HDAC2 (0.52) | HDAC2HDAC1HDAC3 | |
| SCHEMBL31109094 | 0.86 | HDAC2 (0.72) | HDAC2HDAC1HDAC3 | |
| SCHEMBL31108953 | 0.85 | HDAC1 (0.47) | HDAC2HDAC1HDAC3 | |
| SCHEMBL31109040 | 0.84 | HDAC2 (0.58) | HDAC2HDAC1HDAC3 | |
| SCHEMBL25251026 | 0.84 | HDAC2 (0.69) | HDAC2HDAC1HDAC3 | |
| SCHEMBL25249960 | 0.82 | HDAC2 (0.57) | HDAC2HDAC1HDAC3CHEK1NTRK1 |
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-118715206-A | Novel HDAC inhibitors and therapeutic uses thereof | 探戈医药股份有限公司 | 2024-09-27 | — | — | CN | disclosed |