Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 20/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 10/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.43 |
| ▸ | PLK3 | Q9H4B4 | 7/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | NEK2 | P51955 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13440384 | 0.87 | PLK1 (0.44) | PLK1CYP3A4CYP2C9PLK3PIK3CD | |
| SCHEMBL3257571 | 0.87 | PLK1 (0.44) | PLK1CYP3A4CYP2C9PLK3PIK3CD | |
| SCHEMBL13621653 | 0.84 | PLK1 (0.48) | PLK1CYP3A4CYP2C9PLK3 | |
| SCHEMBL3255055 | 0.84 | PLK1 (0.48) | PLK1CYP3A4CYP2C9PLK3 | |
| SCHEMBL3250730 | 0.82 | PLK1 (0.60) | PLK1CYP3A4CYP2C9PLK3PIK3CD | |
| SCHEMBL13440388 | 0.82 | PLK1 (0.60) | PLK1CYP3A4CYP2C9PLK3PIK3CD | |
| SCHEMBL3687448 | 0.82 | PLK1 (0.45) | PLK1CYP3A4CYP2C9PLK3PIK3CD | |
| SCHEMBL3248757 | 0.82 | PLK1 (0.51) | PLK1CYP3A4CYP2C9PLK3 | |
| SCHEMBL13440382 | 0.82 | PLK1 (0.51) | PLK1CYP3A4CYP2C9PLK3 | |
| SCHEMBL13440387 | 0.81 | PLK1 (0.50) | PLK1CYP3A4CYP2C9PLK3PIK3CD |
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 | disclosed |