Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 7/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 6/20 | 0.43 |
| ▸ | CHEK2 | O96017 | 6/20 | 0.43 |
| ▸ | PRKACA | P17612 | 6/20 | 0.43 |
| ▸ | RPS6KA3 | P51812 | 6/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 6/20 | 0.43 |
| ▸ | CDC42BPA | Q5VT25 | 6/20 | 0.43 |
| ▸ | AKT1 | P31749 | 5/20 | 0.43 |
| ▸ | GSK3B | P49841 | 5/20 | 0.43 |
| ▸ | PRKG1 | Q13976 | 5/20 | 0.43 |
| ▸ | PKN2 | Q16513 | 5/20 | 0.43 |
| ▸ | HIPK4 | Q8NE63 | 5/20 | 0.43 |
| ▸ | PRKAA1 | Q13131 | 5/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.43 |
| ▸ | GSK3A | P49840 | 5/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.43 |
| ▸ | PRKG2 | Q13237 | 4/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.43 |
| ▸ | MKNK2 | Q9HBH9 | 4/20 | 0.43 |
| ▸ | SGK2 | Q9HBY8 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4598328 | 0.88 | GSK3B (0.43) | AURKBRPS6KB1CHEK2PRKACARPS6KA3 | |
| SCHEMBL4908175 | 0.84 | RPS6KB1 (0.43) | AURKBRPS6KB1CHEK2PRKACARPS6KA3 | |
| SCHEMBL4596911 | 0.82 | NAMPT (0.47) | AURKBRPS6KB1CHEK2PRKACARPS6KA3 | |
| SCHEMBL4905587 | 0.80 | ROCK1 (0.48) | AURKBRPS6KB1CHEK2PRKACARPS6KA3 | |
| SCHEMBL4919796 | 0.77 | GSK3B (0.48) | AURKBRPS6KB1CHEK2PRKACARPS6KA3 | |
| SCHEMBL4598858 | 0.76 | GSK3B (0.39) | AURKBRPS6KB1CHEK2PRKACARPS6KA3 | |
| SCHEMBL4598401 | 0.76 | KDR (0.47) | AURKBRPS6KB1ABL1KDRAURKA | |
| SCHEMBL4898767 | 0.76 | RPS6KB1 (0.40) | AURKBRPS6KB1CHEK2PRKACARPS6KA3 | |
| SCHEMBL4906437 | 0.76 | RPS6KB1 (0.43) | AURKBRPS6KB1CHEK2PRKACARPS6KA3 | |
| SCHEMBL4898803 | 0.74 | ROCK2 (0.50) | AURKBRPS6KB1CHEK2PRKACARPS6KA3 |
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-1910312-A1 | QUADRATIC ACID II DERIVATIVES | Merck Patent GmbH (DE) | 2008-04-16 | — | — | EP | claimed |
| WO-2007014608-A1 | QUADRATIC ACID II DERIVATIVES | MERCK PATENT GMBH (DE) | 2007-02-08 | — | — | WO | claimed |