Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 11/20 | 0.52 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | MAPK9 | P45984 | 3/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.47 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.47 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.47 |
| ▸ | CDC42BPA | Q5VT25 | 2/20 | 0.47 |
| ▸ | MINK1 | Q8N4C8 | 2/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.47 |
| ▸ | LYN | P07948 | 1/20 | 0.47 |
| ▸ | PRKACA | P17612 | 1/20 | 0.47 |
| ▸ | PRKCI | P41743 | 1/20 | 0.47 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.47 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.47 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.47 |
| ▸ | MAP3K10 | Q02779 | 1/20 | 0.47 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.47 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6937134 | 0.97 | CYP3A4 (0.47) | CYP3A4GSK3BMAPK9MAPK14MAPK13 | |
| SCHEMBL6929508 | 0.91 | CYP3A4 (0.55) | CYP3A4GSK3BMAPK9MAPK14MAPK13 | |
| SCHEMBL7454606 | 0.89 | MAPK14 (0.47) | CYP3A4GSK3BMAPK9MAPK14MAPK13 | |
| SCHEMBL8327447 | 0.87 | GSK3B (0.53) | CYP3A4GSK3BMAPK9MAPK14MAPK13 | |
| SCHEMBL6931494 | 0.85 | MAPK14 (0.54) | CYP3A4GSK3BMAPK9MAPK14MAPK13 | |
| Dimethylamine SCHEMBL8176050 | 0.83 | MAPK14 (0.52) | CYP3A4GSK3BMAPK9MAPK14MAPK13 | |
| SCHEMBL6936492 | 0.83 | PRKCI (0.61) | CYP3A4GSK3BMAPK9MAPK14MAPK13 | |
| SCHEMBL6936491 | 0.83 | PRKCI (0.61) | CYP3A4GSK3BMAPK9MAPK14MAPK13 | |
| SCHEMBL6932108 | 0.83 | MAPK14 (0.52) | CYP3A4GSK3BMAPK9MAPK14MAPK13 | |
| SCHEMBL8170272 | 0.83 | MAPK14 (0.45) | CYP3A4GSK3BMAPK9MAPK14MAPK13 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0948496-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDONE COMPOUNDS AND METHODS OF USE | Amgen inc. (US) | 1999-10-13 | — | — | EP | disclosed |
| WO-1998024780-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDINONE COMPOUNDS AND THEIR USE | AMGEN INC. (US) | 1998-06-11 | — | — | WO | disclosed |