Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 4/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.39 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 6/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 3/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.31 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | TNK2 | Q07912 | 2/20 | 0.30 |
| ▸ | LCK | P06239 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1905623 | 0.84 | CHEK1 (0.39) | AURKACHEK1MAP2K1EGFRAKT1 | |
| SCHEMBL14119196 | 0.78 | AURKA (0.41) | AURKACHEK1MAP2K1EGFRCDK1 | |
| SCHEMBL1905535 | 0.75 | AURKA (0.41) | AURKACHEK1MAP2K1EGFRCDK1 | |
| SCHEMBL1903999 | 0.72 | AURKA (0.36) | AURKACHEK1MAP2K1AKT1 | |
| SCHEMBL1904145 | 0.71 | AURKA (0.50) | AURKACHEK1MAP2K1EGFRCDK1 | |
| SCHEMBL1904186 | 0.71 | AURKA (0.43) | AURKACHEK1MAP2K1EGFRCDK1 | |
| SCHEMBL1904890 | 0.71 | AKT1 (0.41) | CHEK1AKT1TNK2LCK | |
| SCHEMBL14119148 | 0.71 | TACR3 (0.39) | AURKACHEK1AKT1HDAC3HDAC1 | |
| SCHEMBL14118769 | 0.70 | TACR3 (0.39) | CHEK1AKT1HDAC3HDAC1HDAC2 | |
| SCHEMBL14118904 | 0.70 | TACR3 (0.37) | AURKACHEK1AKT1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2496566-A1 | AKT / PKB INHIBITORS | Almac Discovery Limited (GB) | 2012-09-12 | — | — | EP | disclosed |
| WO-2011055115-A1 | AKT / PKB INHIBITORS | ALMAC DISCOVERY LIMITED (GB) | 2011-05-12 | — | — | WO | disclosed |