Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 4/20 | 0.52 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.43 |
| ▸ | CHEK2 | O96017 | 4/20 | 0.43 |
| ▸ | PRKACA | P17612 | 4/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 4/20 | 0.43 |
| ▸ | AKT1 | P31749 | 4/20 | 0.43 |
| ▸ | GSK3B | P49841 | 4/20 | 0.43 |
| ▸ | RPS6KA3 | P51812 | 4/20 | 0.43 |
| ▸ | PRKG1 | Q13976 | 4/20 | 0.43 |
| ▸ | PKN2 | Q16513 | 4/20 | 0.43 |
| ▸ | CDC42BPA | Q5VT25 | 4/20 | 0.43 |
| ▸ | HIPK4 | Q8NE63 | 4/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.43 |
| ▸ | AKT2 | P31751 | 3/20 | 0.43 |
| ▸ | CLK2 | P49760 | 3/20 | 0.43 |
| ▸ | PRKAA1 | Q13131 | 3/20 | 0.43 |
| ▸ | PRKG2 | Q13237 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4598968 | 0.91 | RPS6KB1 (0.43) | KDRROCK1ROCK2CHEK2PRKACA | |
| SCHEMBL4597939 | 0.85 | KDR (0.48) | KDRPLK1ROCK1ROCK2CHEK2 | |
| SCHEMBL30513613 | 0.79 | SYK (0.48) | KDRPLK1GSK3BCLK2CLK4 | |
| SCHEMBL28639993 | 0.79 | SYK (0.48) | KDRPLK1GSK3BCLK2CLK4 | |
| SCHEMBL4905846 | 0.79 | MAPKAPK2 (0.61) | PLK1ROCK1ROCK2CHEK2GSK3B | |
| SCHEMBL4897789 | 0.79 | MAPKAPK2 (0.61) | PLK1ROCK1ROCK2CHEK2GSK3B | |
| SCHEMBL4906887 | 0.78 | MAPKAPK2 (0.54) | KDRROCK1ROCK2CHEK2PRKACA | |
| SCHEMBL4596911 | 0.78 | NAMPT (0.47) | KDRROCK1ROCK2CHEK2PRKACA | |
| SCHEMBL4597203 | 0.77 | KMT2A (0.46) | KDRROCK1ROCK2CHEK2PRKACA | |
| SCHEMBL4902096 | 0.77 | NOTUM (0.43) | KDRROCK1ROCK2CHEK2PRKACA |
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 |