Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 18/20 | 0.76 |
| ▸ | CCNA2 | P20248 | 9/20 | 0.76 |
| ▸ | CDK2 | P24941 | 9/20 | 0.76 |
| ▸ | CCNA1 | P78396 | 9/20 | 0.76 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.50 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28841889 | 0.91 | AURKA (0.76) | AURKACCNA2CDK2CCNA1AURKB | |
| SCHEMBL28841828 | 0.90 | AURKA (0.74) | AURKACCNA2CDK2CCNA1AURKB | |
| SCHEMBL28841859 | 0.88 | AURKA (0.71) | AURKACCNA2CDK2CCNA1AURKB | |
| SCHEMBL28841876 | 0.87 | CCNA2 (0.59) | AURKACCNA2CDK2CCNA1AURKB | |
| SCHEMBL28953143 | 0.86 | AURKA (0.69) | AURKACCNA2CDK2CCNA1AURKB | |
| SCHEMBL2918134 | 0.86 | AURKA (1.00) | AURKACCNA2CDK2CCNA1AURKB | |
| SCHEMBL2922424 | 0.85 | AURKA (0.80) | AURKACCNA2CDK2CCNA1AURKB | |
| SCHEMBL28841936 | 0.83 | AURKA (0.64) | AURKACCNA2CDK2CCNA1AURKB | |
| SCHEMBL2916467 | 0.83 | AURKA (0.72) | AURKACCNA2CDK2CCNA1AURKB | |
| SCHEMBL2922578 | 0.83 | AURKA (0.75) | AURKACCNA2CDK2CCNA1AURKB |
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-115057860-B | ERK inhibitor and pharmaceutical application thereof | 四川大学华西医院 | 2024-02-09 | — | — | CN | disclosed |
| CN-115057860-A | ERK inhibitor and pharmaceutical application thereof | 四川大学华西医院 | 2022-09-16 | — | — | CN | disclosed |