Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 19/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 10/20 | 0.67 |
| ▸ | PLK3 | Q9H4B4 | 8/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.60 |
| ▸ | NEK2 | P51955 | 4/20 | 0.56 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.56 |
| ▸ | NUAK1 | O60285 | 2/20 | 0.56 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.56 |
| ▸ | PIM1 | P11309 | 2/20 | 0.56 |
| ▸ | KDR | P35968 | 2/20 | 0.56 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL13440308 | 1.00 | PLK1 (0.67) | PLK1CYP3A4PLK3CYP2C9NEK2 | |
| Trifluoroacetic Acid SCHEMBL3253703 | 0.96 | PLK1 (0.63) | PLK1CYP3A4PLK3CYP2C9NEK2 | |
| SCHEMBL3601044 | 0.94 | PLK1 (0.59) | PLK1CYP3A4PLK3CYP2C9NEK2 | |
| SCHEMBL3263672 | 0.94 | PLK1 (0.63) | PLK1CYP3A4PLK3CYP2C9NEK2 | |
| SCHEMBL3256513 | 0.94 | PLK1 (0.63) | PLK1CYP3A4PLK3CYP2C9NEK2 | |
| SCHEMBL3265414 | 0.93 | PLK1 (0.57) | PLK1CYP3A4PLK3CYP2C9NEK2 | |
| SCHEMBL3265412 | 0.93 | PLK1 (0.57) | PLK1CYP3A4PLK3CYP2C9NEK2 | |
| SCHEMBL3254712 | 0.93 | PLK1 (0.66) | PLK1CYP3A4PLK3CYP2C9 | |
| SCHEMBL13440302 | 0.93 | PLK1 (0.66) | PLK1CYP3A4PLK3CYP2C9 | |
| SCHEMBL3263687 | 0.91 | PLK1 (0.61) | PLK1CYP3A4PLK3CYP2C9NEK2 |
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 |