Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 5/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.42 |
| ▸ | CHEK2 | O96017 | 4/20 | 0.42 |
| ▸ | GSK3A | P49840 | 4/20 | 0.42 |
| ▸ | GSK3B | P49841 | 4/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.42 |
| ▸ | PKN2 | Q16513 | 4/20 | 0.42 |
| ▸ | CDC42BPA | Q5VT25 | 4/20 | 0.42 |
| ▸ | CSNK1G3 | Q9Y6M4 | 4/20 | 0.42 |
| ▸ | CSNK1G2 | P78368 | 3/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.42 |
| ▸ | CSNK1G1 | Q9HCP0 | 3/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.42 |
| ▸ | PRKACA | P17612 | 3/20 | 0.42 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.42 |
| ▸ | AKT1 | P31749 | 3/20 | 0.42 |
| ▸ | RPS6KA3 | P51812 | 3/20 | 0.42 |
| ▸ | NEK4 | P51957 | 3/20 | 0.42 |
| ▸ | PRKG1 | Q13976 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7894993 | 0.83 | ABCC9 (0.47) | PLK1CHEK1CHEK2GSK3AGSK3B | |
| SCHEMBL7895225 | 0.82 | CHEK2 (0.45) | CHEK1CHEK2GSK3AGSK3BROCK1 | |
| SCHEMBL7894753 | 0.82 | PLK1 (0.48) | PLK1CHEK1CHEK2GSK3AGSK3B | |
| SCHEMBL7894756 | 0.82 | PLK1 (0.48) | PLK1CHEK1CHEK2GSK3AGSK3B | |
| SCHEMBL7898521 | 0.80 | CNR2 (0.37) | PLK1CHEK1CHEK2GSK3AGSK3B | |
| SCHEMBL7895721 | 0.78 | ABCC9 (0.43) | PLK1CHEK1CHEK2GSK3AGSK3B | |
| SCHEMBL7895090 | 0.78 | ABCC9 (0.45) | PLK1CHEK1CHEK2GSK3AGSK3B | |
| SCHEMBL7597380 | 0.78 | ROCK2 (0.46) | PLK1CHEK1CHEK2GSK3AGSK3B | |
| SCHEMBL7597329 | 0.78 | ROCK2 (0.46) | PLK1CHEK1CHEK2GSK3AGSK3B | |
| SCHEMBL7600179 | 0.78 | ROCK2 (0.46) | PLK1CHEK1CHEK2GSK3AGSK3B |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1151990-A1 | Substituted N-arylmethylamino derivatives of cyclobutene-3, 4-diones | AMERICAN HOME PRODUCTS CORPORATION (US) | 2001-11-07 | — | — | EP | claimed |
| EP-0934257-A1 | SUBSTITUTED N-ARYLMETHYLAMINO DERIVATIVES OF CYCLOBUTENE-3,4-DIONES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-08-11 | — | — | EP | claimed |
| US-5780505-A | ADMINISTERING AS SMOOTH MUSCLE RELAXANT | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-07-14 | — | — | US | claimed |
| WO-1998002413-A1 | SUBSTITUTED N-ARYLMETHYLAMINO DERIVATIVES OF CYCLOBUTENE-3,4-DIONES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-01-22 | — | — | WO | claimed |
| EP-1151990-A1 | Substituted N-arylmethylamino derivatives of cyclobutene-3, 4-diones | AMERICAN HOME PRODUCTS CORPORATION (US) | 2001-11-07 | — | — | EP | disclosed |
| EP-0934257-A1 | SUBSTITUTED N-ARYLMETHYLAMINO DERIVATIVES OF CYCLOBUTENE-3,4-DIONES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-08-11 | — | — | EP | disclosed |
| US-5780505-A | ADMINISTERING AS SMOOTH MUSCLE RELAXANT | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-07-14 | — | — | US | disclosed |
| WO-1998002413-A1 | SUBSTITUTED N-ARYLMETHYLAMINO DERIVATIVES OF CYCLOBUTENE-3,4-DIONES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-01-22 | — | — | WO | disclosed |