Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.53 |
| ▸ | MET | P08581 | 4/20 | 0.51 |
| ▸ | ATR | Q13535 | 4/20 | 0.50 |
| ▸ | CSF1R | P07333 | 2/20 | 0.49 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.47 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL488017 | 1.00 | KCNH2 (0.53) | KCNH2METATRCSF1RCCNE2 | |
| SCHEMBL488822 | 0.91 | ATR (0.53) | KCNH2METATRCSF1RAURKA | |
| SCHEMBL30452937 | 0.91 | ATR (0.53) | KCNH2METATRCSF1RAURKA | |
| SCHEMBL30453638 | 0.86 | MET (0.54) | KCNH2METATRCSF1R | |
| SCHEMBL488190 | 0.86 | MET (0.54) | KCNH2METATRCSF1R | |
| SCHEMBL488137 | 0.85 | MET (0.54) | KCNH2METATRCSF1R | |
| SCHEMBL10216280 | 0.85 | KCNH2 (0.58) | KCNH2METATRCSF1RMKNK1 | |
| SCHEMBL30453714 | 0.85 | MET (0.54) | KCNH2METATRCSF1R | |
| SCHEMBL10216276 | 0.85 | MET (0.54) | KCNH2METATRCSF1R | |
| SCHEMBL487921 | 0.85 | KCNH2 (0.58) | KCNH2METATRCSF1RMKNK1 |
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-113181362-B | Medicament for preventing and/or treating amyotrophic lateral sclerosis | 国立大学法人京都大学 | 2023-06-13 | — | — | CN | disclosed |