Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 20/20 | 0.61 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.57 |
| ▸ | PLK4 | O00444 | 3/20 | 0.57 |
| ▸ | DAPK3 | O43293 | 3/20 | 0.57 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.57 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.57 |
| ▸ | PIM1 | P11309 | 3/20 | 0.57 |
| ▸ | GSK3A | P49840 | 3/20 | 0.57 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.57 |
| ▸ | CDC42BPA | Q5VT25 | 3/20 | 0.57 |
| ▸ | PLK3 | Q9H4B4 | 3/20 | 0.57 |
| ▸ | CDC7 | O00311 | 2/20 | 0.57 |
| ▸ | GSK3B | P49841 | 2/20 | 0.57 |
| ▸ | PRKX | P51817 | 2/20 | 0.57 |
| ▸ | CSNK1G2 | P78368 | 2/20 | 0.57 |
| ▸ | PRKCZ | Q05513 | 2/20 | 0.57 |
| ▸ | PKN2 | Q16513 | 2/20 | 0.57 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.57 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.57 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL7357470 | 0.84 | PLK1 (0.61) | PLK1CHEK1PLK4DAPK3ROCK2 | |
| SCHEMBL7354053 | 0.83 | PLK1 (0.50) | PLK1CHEK1PLK4ROCK2CHEK2 | |
| SCHEMBL8674402 | 0.81 | NPC1 (0.52) | PLK1AURKASLK | |
| SCHEMBL29120686 | 0.80 | ALDH1A1 (0.59) | SLK | |
| SCHEMBL8672647 | 0.79 | PLK1 (0.59) | PLK1CHEK1PLK4DAPK3ROCK2 | |
| SCHEMBL29120687 | 0.78 | ALDH1A1 (0.53) | PLK1CHEK1PLK4DAPK3ROCK2 | |
| SCHEMBL29120695 | 0.77 | NPC1 (0.61) | ROCK2GSK3AROCK1GSK3BCLK4 | |
| SCHEMBL1927766 | 0.76 | PLK1 (1.00) | PLK1CHEK1PLK4DAPK3ROCK2 | |
| SCHEMBL1927178 | 0.76 | PLK1 (1.00) | PLK1CHEK1PLK4DAPK3ROCK2 | |
| SCHEMBL8668406 | 0.76 | NPC1 (0.52) | DYRK1ASLK |
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-0729457-B1 | DIAMINOCYCLOBUTENE-3,4-DIONES AS SMOOTH MUSCLE RELAXANTS | AMERICAN HOME PROD (US) | 1998-12-23 | — | — | EP | claimed |