Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.48 |
| ▸ | FDPS | P14324 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.37 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4726854 | 0.83 | CYP2D6 (0.61) | CYP2D6FAAHKDM4EMAPK1 | |
| SCHEMBL14292081 | 0.83 | CYP2D6 (0.61) | CYP2D6FAAHKDM4EMAPK1 | |
| SCHEMBL4847869 | 0.83 | CYP2D6 (0.61) | CYP2D6FAAHKDM4EMAPK1 | |
| SCHEMBL4795166 | 0.80 | STK17A (0.53) | CYP2D6MAPK1 | |
| SCHEMBL14292805 | 0.80 | AURKA (0.51) | CYP2D6 | |
| SCHEMBL4725050 | 0.79 | AURKA (0.55) | CYP2D6MAPK1 | |
| SCHEMBL4728067 | 0.78 | ADRB2 (0.40) | CYP2D6MKNK1MKNK2CYP3A4FAAH | |
| SCHEMBL4725581 | 0.78 | FAAH (0.48) | CYP2D6MKNK1MKNK2CYP3A4SLC6A2 | |
| SCHEMBL4838929 | 0.78 | IGF1R (0.51) | MAPK1 | |
| SCHEMBL4727667 | 0.76 | FAAH (0.46) | CYP2D6CYP3A4FAAHALDH1A1GBA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008024634-A1 | PYRIMDINE COMPOUNDS USEFUL AS KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-02-28 | — | — | WO | disclosed |