Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 7/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 8/20 | 0.44 |
| ▸ | BRAF | P15056 | 4/20 | 0.39 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.39 |
| ▸ | PLK4 | O00444 | 1/20 | 0.39 |
| ▸ | PIR | O00625 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.39 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.39 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.39 |
| ▸ | STK16 | O75716 | 1/20 | 0.39 |
| ▸ | OXSR1 | O95747 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | RAF1 | P04049 | 1/20 | 0.39 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | FES | P07332 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 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 | |
|---|---|---|---|---|
| SCHEMBL1723925 | 0.88 | CYP3A4 (0.49) | CYP2C9CYP3A4CYP2C19BRAFBMPR1B | |
| SCHEMBL299522 | 0.87 | CYP2C9 (0.49) | CYP2C9CYP3A4CYP2C19BRAFBMPR1B | |
| SCHEMBL287714 | 0.86 | CYP3A4 (0.40) | CYP2C9CYP3A4CYP2C19BRAFBMPR1B | |
| SCHEMBL297797 | 0.85 | CYP3A4 (0.48) | CYP2C9CYP3A4CYP2C19BRAFBMPR1B | |
| SCHEMBL1721219 | 0.82 | CYP3A4 (0.60) | CYP2C9CYP3A4CYP2C19BRAFBMPR1B | |
| SCHEMBL1720729 | 0.76 | CYP2C9 (0.66) | CYP2C9CYP3A4CYP2C19BRAFNEK2 | |
| SCHEMBL994632 | 0.76 | BRAF (0.45) | CYP2C9CYP3A4CYP2C19BRAFBMPR1B | |
| SCHEMBL995687 | 0.75 | BRAF (0.56) | CYP2C9CYP3A4CYP2C19BRAFBMPR1B | |
| SCHEMBL413438 | 0.75 | BRAF (0.45) | CYP2C9CYP3A4CYP2C19BRAFBMPR1B | |
| SCHEMBL285511 | 0.75 | BRAF (0.44) | CYP2C9CYP3A4CYP2C19BRAFBMPR1B |
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 |