Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 3/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.40 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.40 |
| ▸ | AURKC | Q9UQB9 | 1/20 | 0.40 |
| ▸ | ITK | Q08881 | 13/20 | 0.36 |
| ▸ | IL2 | P60568 | 4/20 | 0.36 |
| ▸ | PIP5K1C | O60331 | 2/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 2/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.33 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4948590 | 0.90 | AURKA (0.46) | AURKAAURKBFLT3LIMK1LIMK2 | |
| SCHEMBL4946077 | 0.84 | ITK (0.37) | AURKAAURKBITKIL2 | |
| SCHEMBL4946046 | 0.80 | AURKA (0.42) | AURKAAURKBITKIL2 | |
| SCHEMBL4955138 | 0.78 | AURKA (0.44) | AURKAAURKBFLT3LIMK1LIMK2 | |
| SCHEMBL4950836 | 0.76 | AURKA (0.40) | AURKAAURKBFLT3ITKIL2 | |
| SCHEMBL4948278 | 0.76 | AURKA (0.42) | AURKAAURKBFLT3ITKIL2 | |
| SCHEMBL4948961 | 0.75 | AURKA (0.53) | AURKAAURKBFLT3ITKIL2 | |
| SCHEMBL4946021 | 0.74 | AURKA (0.39) | AURKAAURKBITKIL2 | |
| SCHEMBL4943760 | 0.72 | AURKA (0.50) | AURKAAURKBFLT3ITKIL2 | |
| SCHEMBL4886259 | 0.71 | FGFR1 (0.48) | AURKAAURKBFLT3LIMK1ITK |
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 |
|---|---|---|---|---|---|---|---|
| EP-1885725-B1 | TRICYCLIC AZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-09-24 | — | — | EP | disclosed |