Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FABP6 | P51161 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TYMS | P04818 | 2/20 | 0.32 |
| ▸ | PLAU | P00749 | 1/20 | 0.31 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.31 |
| ▸ | HTR3B | O95264 | 1/20 | 0.31 |
| ▸ | HTR3A | P46098 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.31 |
| ▸ | HTR3C | Q8WXA8 | 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 | |
|---|---|---|---|---|
| SCHEMBL3426557 | 1.00 | FABP6 (0.38) | FABP6AURKAAURKBALDH1A1TDP1 | |
| SCHEMBL2491924 | 0.79 | AURKA (0.45) | FABP6AURKAAURKBALDH1A1TDP1 | |
| SCHEMBL2490723 | 0.79 | MPI (0.30) | TDP1 | |
| SCHEMBL13341629 | 0.76 | NPC1 (0.46) | — | |
| SCHEMBL13367949 | 0.74 | AURKA (0.47) | FABP6AURKAAURKBALDH1A1TDP1 | |
| SCHEMBL2492686 | 0.74 | AURKA (0.44) | FABP6AURKAAURKBALDH1A1TDP1 | |
| SCHEMBL3424973 | 0.73 | AURKA (0.44) | FABP6AURKAAURKBALDH1A1TDP1 | |
| SCHEMBL2491051 | 0.72 | AURKA (0.41) | FABP6AURKAAURKBALDH1A1TDP1 | |
| SCHEMBL2487407 | 0.71 | AURKA (0.64) | FABP6AURKAAURKBALDH1A1TDP1 | |
| SCHEMBL2488374 | 0.71 | TDP1 (0.51) | ALDH1A1TDP1 |
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 |