Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
| ▸ | PNP | P00491 | 5/20 | 0.37 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
| ▸ | FABP6 | P51161 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | TYMS | P04818 | 10/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2490810 | 0.82 | AURKA (0.40) | AURKAAURKBRAF1BRAFFABP6 | |
| SCHEMBL13367949 | 0.78 | AURKA (0.47) | AURKAAURKBRAF1BRAFFABP6 | |
| SCHEMBL2491924 | 0.78 | AURKA (0.45) | AURKAAURKBRAF1BRAFFABP6 | |
| SCHEMBL2488865 | 0.78 | AURKA (0.42) | AURKAAURKBRAF1BRAFFABP6 | |
| SCHEMBL2490394 | 0.76 | AURKA (0.42) | AURKAAURKBRAF1BRAFFABP6 | |
| SCHEMBL10693758 | 0.76 | AURKA (0.41) | AURKAAURKBPNPALDH1A1 | |
| SCHEMBL2487407 | 0.76 | AURKA (0.64) | AURKAAURKBRAF1BRAFFABP6 | |
| SCHEMBL3424973 | 0.74 | AURKA (0.44) | AURKAAURKBRAF1BRAFFABP6 | |
| SCHEMBL2489572 | 0.74 | AURKA (0.37) | AURKAAURKBTYMS | |
| SCHEMBL2491051 | 0.74 | AURKA (0.41) | AURKAAURKBFABP6ALDH1A1TDP1 |
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-1756112-B1 | PYRROLOBENZIMIDAZOLONES AND THEIR USE AS ANTIPROLIFERATIVE AGENTS | BOEHRINGER INGELHEIM INT (DE) | 2011-10-26 | — | — | EP | disclosed |