Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 8/20 | 0.62 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5391583 | 0.86 | GSK3B (0.67) | GSK3BNPC1RAB9AMAPK13RAF1 | |
| SCHEMBL5386526 | 0.81 | S1PR1 (0.51) | GSK3BS1PR1KDM4EMAPTGAA | |
| SCHEMBL5383553 | 0.80 | GSK3B (0.72) | GSK3BNPC1RAB9AMAPK14 | |
| SCHEMBL5381549 | 0.78 | GSK3B (1.00) | GSK3BMAPTGAASMN1; SMN2ALDH1A1 | |
| SCHEMBL5377580 | 0.77 | GSK3B (0.87) | GSK3BMAPTGAAROCK2ROCK1 | |
| SCHEMBL7391408 | 0.77 | GSK3B (0.72) | GSK3BKDM4EMAPTSMN1; SMN2TP53 | |
| SCHEMBL5392045 | 0.77 | GSK3B (0.72) | GSK3BGAAROCK2ROCK1NPC1 | |
| Hydrochloric Acid SCHEMBL5386672 | 0.75 | GSK3B (0.61) | GSK3BSMN1; SMN2ROCK2MAPK14 | |
| SCHEMBL5388178 | 0.74 | GSK3B (0.67) | GSK3BMAPK13RAF1MAPK12MAPK11 | |
| SCHEMBL5376063 | 0.74 | GSK3B (0.76) | GSK3BKDM4EMAPTSMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7256199-B1 | Pyrimidone derivatives | MITSUBISHI CHEMICAL CORPORATION (JP) | 2007-08-14 | — | — | US | disclosed |
| EP-1115721-B1 | PYRIMIDONE DERIVATIVES | MITSUBISHI CHEM CORP (JP) | 2003-12-10 | — | — | EP | disclosed |
| EP-1115721-A1 | PYRIMIDONE DERIVATIVES | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-07-18 | — | — | EP | disclosed |
| WO-2000018758-A1 | PYRIMIDONE DERIVATIVES | MITSUBISHI CHEMICAL CORPORATION (JP) | 2000-04-06 | — | — | WO | disclosed |