Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 3/20 | 0.40 |
| ▸ | AURKA | O14965 | 2/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.40 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.31 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.31 |
| ▸ | INSR | P06213 | 1/20 | 0.31 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
| ▸ | CSF1R | P07333 | 1/20 | 0.31 |
| ▸ | LYN | P07948 | 1/20 | 0.31 |
| ▸ | RET | P07949 | 1/20 | 0.31 |
| ▸ | KIT | P10721 | 1/20 | 0.31 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.31 |
| ▸ | FER | P16591 | 1/20 | 0.31 |
| ▸ | FLT1 | P17948 | 1/20 | 0.31 |
| ▸ | RPS6KB1 | P23443 | 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 | |
|---|---|---|---|---|
| SCHEMBL18341971 | 0.83 | KDR (0.40) | KDRAURKAAURKBEPHB4PLK4 | |
| SCHEMBL29503401 | 0.79 | KDR (0.57) | KDRAURKAAURKBEPHB4PLK4 | |
| SCHEMBL29503516 | 0.79 | KDR (0.41) | KDRAURKAAURKBEPHB4PLK4 | |
| SCHEMBL868356 | 0.79 | KDR (0.57) | KDRAURKAAURKBEPHB4PLK4 | |
| SCHEMBL379508 | 0.79 | KDR (0.41) | KDRAURKAAURKBEPHB4PLK4 | |
| SCHEMBL17176672 | 0.79 | KDR (0.38) | KDRAURKAAURKBEPHB4PLK4 | |
| SCHEMBL30958677 | 0.79 | KDR (0.38) | KDRAURKAAURKBEPHB4PLK4 | |
| SCHEMBL3785902 | 0.75 | CSNK2A1 (0.37) | KDRAURKAAURKBEPHB4 | |
| SCHEMBL5466073 | 0.68 | NPC1 (0.36) | KDRAURKAAURKB | |
| SCHEMBL3689314 | 0.68 | HRH4 (0.46) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1968979-A2 | 9-MEMBERED HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PROTEIN KINASES | ABBOTT LABORATORIES (US) | 2008-09-17 | — | — | EP | disclosed |
| WO-2007067781-A2 | 9-MEMBERED HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PROTEIN KINASES | ABBOTT LABORATORIES (US) | 2007-06-14 | — | — | WO | disclosed |