Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 8/20 | 0.61 |
| ▸ | FLT3 | P36888 | 1/20 | 0.56 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.56 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.56 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.56 |
| ▸ | AURKC | Q9UQB9 | 1/20 | 0.56 |
| ▸ | CCNA2 | P20248 | 12/20 | 0.43 |
| ▸ | CDK2 | P24941 | 12/20 | 0.43 |
| ▸ | CCNA1 | P78396 | 12/20 | 0.43 |
| ▸ | RBP4 | P02753 | 3/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.38 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.37 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.37 |
| ▸ | CDK1 | P06493 | 2/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | GSK3B | P49841 | 2/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4949121 | 0.90 | AURKA (0.62) | AURKAFLT3LIMK1LIMK2AURKB | |
| SCHEMBL4726438 | 0.86 | AURKA (0.63) | AURKAFLT3LIMK1LIMK2AURKB | |
| SCHEMBL4946521 | 0.86 | AURKA (0.58) | AURKAFLT3LIMK1LIMK2AURKB | |
| Pha-680632 SCHEMBL12582821 | 0.72 | AURKA (1.00) | AURKAFLT3LIMK1LIMK2AURKB | |
| SCHEMBL13446065 | 0.68 | AURKA (0.91) | AURKAFLT3LIMK1LIMK2AURKB | |
| SCHEMBL4782288 | 0.67 | AURKA (0.57) | AURKACCNA2CDK2CCNA1 | |
| SCHEMBL4948556 | 0.67 | POLB (0.67) | — | |
| SCHEMBL4726431 | 0.67 | AURKA (0.40) | AURKAFLT3LIMK1LIMK2AURKB | |
| SCHEMBL15161210 | 0.66 | CYP2C19 (0.39) | CCNA2CDK2CCNA1RBP4 | |
| SCHEMBL4949129 | 0.66 | CCNA2 (0.39) | AURKAFLT3LIMK1LIMK2AURKB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008017465-A1 | BICYCLIC LACTAM DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-02-14 | — | — | WO | claimed |
| WO-2008017465-A1 | BICYCLIC LACTAM DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-02-14 | — | — | WO | disclosed |