Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.41 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.40 |
| ▸ | BRAF | P15056 | 2/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL297872 | 0.92 | CYP2C9 (0.48) | CYP2C9CYP3A4CYP2C19BRAF | |
| SCHEMBL297658 | 0.86 | DYRK1A (0.43) | DYRK1ABRD4CYP2C9CYP3A4MKNK1 | |
| SCHEMBL413409 | 0.83 | BRAF (0.49) | CYP2C9CYP3A4CYP2C19BRAF | |
| SCHEMBL298599 | 0.79 | BRAF (0.58) | CYP2C9CYP3A4CYP2C19BRAF | |
| SCHEMBL3709343 | 0.79 | NEK1 (0.52) | DYRK1ABRD4MKNK1MKNK2PDPK1 | |
| SCHEMBL298841 | 0.78 | CYP2C9 (0.58) | CYP2C9CYP3A4CYP2C19BRAF | |
| SCHEMBL294113 | 0.78 | CYP2C9 (0.54) | CYP2C9CYP3A4CYP2C19BRAF | |
| SCHEMBL297931 | 0.78 | BRAF (0.43) | CYP2C9CYP3A4CYP2C19BRAF | |
| SCHEMBL994632 | 0.77 | BRAF (0.45) | CYP2C9CYP3A4CYP2C19BRAF | |
| SCHEMBL995687 | 0.76 | BRAF (0.56) | CYP2C9CYP3A4CYP2C19BRAF |
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 |
|---|---|---|---|---|---|---|---|
| EP-2427433-A1 | SOLID FORMS OF SULFONAMIDES AND AMINO ACIDS | Plexxikon, Inc. (US) | 2012-03-14 | — | — | EP | disclosed |