Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 4/20 | 0.66 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.56 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.56 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.54 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.54 |
| ▸ | GMNN | O75496 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL5377580 | 0.85 | GSK3B (0.87) | GSK3BMAPTALDH1A1ALOX15MAPK1 | |
| SCHEMBL5380875 | 0.81 | GSK3B (0.75) | GSK3BMAPK14MAPTMAPK13RIPK2 | |
| SCHEMBL5384096 | 0.80 | GSK3B (0.73) | GSK3BNPC1MAPK14RAB9AMEN1 | |
| SCHEMBL7395693 | 0.80 | GSK3B (0.73) | GSK3BNPC1MAPK14MAPTRAB9A | |
| SCHEMBL5400000 | 0.80 | GSK3B (0.73) | GSK3BMAPK14MAPTMAPK13RIPK2 | |
| SCHEMBL13153215 | 0.80 | NPC1 (0.55) | NPC1PKN1PKN2MAPK14MAPT | |
| SCHEMBL5380569 | 0.80 | GSK3B (0.73) | GSK3BNPC1MAPK14MAPTRAB9A | |
| SCHEMBL5381549 | 0.80 | GSK3B (1.00) | GSK3BMAPK14MAPTMAPK13ALDH1A1 | |
| SCHEMBL5380413 | 0.78 | NPC1 (0.56) | NPC1PKN1PKN2MAPK14MAPT | |
| SCHEMBL2406895 | 0.77 | XDH (0.63) | MAPTALDH1A1TDP1 |
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 |