Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 2/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.45 |
| ▸ | GSK3B | P49841 | 2/20 | 0.45 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.45 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.45 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | BUB1 | O43683 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 10/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 10/20 | 0.34 |
| ▸ | TRAP1 | Q12931 | 6/20 | 0.34 |
| ▸ | HSP90B1 | P14625 | 5/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4539183 | 0.84 | HSP90AA1 (0.48) | BUB1HSP90AA1HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL4523147 | 0.79 | HSP90AA1 (0.54) | HSP90AA1HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL4535145 | 0.78 | HSP90AA1 (0.55) | HSP90AA1HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL4536660 | 0.77 | KDM4E (0.44) | CDC7ROCK2MAP4K4GSK3BCLK4 | |
| SCHEMBL4526380 | 0.76 | HSP90AA1 (0.55) | CDC7ROCK2MAP4K4GSK3BCLK4 | |
| SCHEMBL4526880 | 0.74 | HSP90AA1 (0.47) | HSP90AA1HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL4529101 | 0.73 | KDM4E (0.43) | CDC7ROCK2MAP4K4GSK3BCLK4 | |
| SCHEMBL5279605 | 0.70 | HSP90AA1 (0.43) | HSP90AA1HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL1218856 | 0.70 | HSP90AB1 (0.64) | HSP90AA1HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL4531034 | 0.67 | HSP90AA1 (0.42) | BUB1HSP90AA1HSP90AB1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4377942-B2 | — | — | 2009-12-02 | — | — | JP | claimed |
| JP-2008531599-A | — | — | 2008-08-14 | — | — | JP | claimed |
| EP-1856057-A1 | TETRAHYDROINDOLONE AND TETRAHYDROINDAZOLONE DERIVATIVES | Serenex, Inc. (US) | 2007-11-21 | — | — | EP | claimed |
| WO-2006091963-A1 | TETRAHYDROINDOLONE AND TETRAHYDROINDAZOLONE DERIVATIVES | SERENEX, INC. (US) | 2006-08-31 | — | — | WO | claimed |