Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 19/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 11/20 | 0.69 |
| ▸ | PLK3 | Q9H4B4 | 6/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL3254775 | 0.94 | PLK1 (0.72) | PLK1CYP3A4PLK3CYP2C9 | |
| SCHEMBL3263376 | 0.94 | PLK1 (0.72) | PLK1CYP3A4PLK3CYP2C9 | |
| SCHEMBL3256414 | 0.92 | PLK1 (0.66) | PLK1CYP3A4PLK3CYP2C9 | |
| SCHEMBL3598855 | 0.92 | PLK1 (0.66) | PLK1CYP3A4PLK3CYP2C9 | |
| SCHEMBL3252065 | 0.92 | PLK1 (0.71) | PLK1CYP3A4PLK3CYP2C9 | |
| SCHEMBL3259302 | 0.92 | PLK1 (0.71) | PLK1CYP3A4PLK3CYP2C9 | |
| Trifluoroacetic Acid SCHEMBL3254815 | 0.89 | PLK1 (0.66) | PLK1CYP3A4PLK3CYP2C9 | |
| SCHEMBL4505441 | 0.87 | PLK1 (0.78) | PLK1CYP3A4PLK3CYP2C9 | |
| SCHEMBL14344445 | 0.87 | PLK1 (0.77) | PLK1CYP3A4PLK3CYP2C9 | |
| SCHEMBL3254323 | 0.87 | PLK1 (0.57) | PLK1CYP3A4PLK3CYP2C9 |
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-2032563-B1 | BENZIMIDAZOL SUBSTITUTED THIOPHENE DERIVATIVES WITH ACTIVITY ON PLK | GLAXOSMITHKLINE LLC (US) | 2010-06-02 | — | — | EP | claimed |