Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 5/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 8/20 | 0.46 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.46 |
| ▸ | RAF1 | P04049 | 2/20 | 0.46 |
| ▸ | KDR | P35968 | 2/20 | 0.46 |
| ▸ | MAP2K2 | P36507 | 2/20 | 0.46 |
| ▸ | TGFBR2 | P37173 | 2/20 | 0.46 |
| ▸ | NEK2 | P51955 | 2/20 | 0.46 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.46 |
| ▸ | TNK2 | Q07912 | 2/20 | 0.46 |
| ▸ | MAP2K5 | Q13163 | 2/20 | 0.46 |
| ▸ | PTK6 | Q13882 | 2/20 | 0.46 |
| ▸ | NEK11 | Q8NG66 | 2/20 | 0.46 |
| ▸ | MAP3K20 | Q9NYL2 | 2/20 | 0.46 |
| ▸ | MAP4K5 | Q9Y4K4 | 2/20 | 0.46 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.46 |
| ▸ | PLK4 | O00444 | 1/20 | 0.46 |
| ▸ | PIR | O00625 | 1/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7880244 | 0.95 | BRAF (0.44) | BRAFCYP2C9RIPK2RAF1KDR | |
| SCHEMBL7872497 | 0.87 | BRAF (0.56) | BRAFCYP2C9RIPK2RAF1KDR | |
| SCHEMBL7876453 | 0.84 | BTK (0.42) | NEK2STK16MAP2K4PAK1TNIK | |
| SCHEMBL298639 | 0.84 | BRAF (0.54) | BRAFCYP2C9RIPK2RAF1KDR | |
| SCHEMBL299283 | 0.84 | BRAF (0.69) | BRAFCYP2C9RIPK2RAF1KDR | |
| SCHEMBL7869167 | 0.83 | CYP2C9 (0.44) | CYP2C9CLK1CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL7874309 | 0.83 | EGFR (0.44) | BRAFCYP2C9KDRFGFR1CYP3A4 | |
| SCHEMBL7878749 | 0.83 | BRAF (0.50) | BRAFCYP2C9RIPK2RAF1KDR | |
| SCHEMBL7868957 | 0.82 | CYP3A4 (0.51) | CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL19565631 | 0.82 | BRAF (0.61) | BRAFCYP2C9RIPK2RAF1KDR |
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-2010129570-A1 | SOLID FORMS OF SULFONAMIDES AND AMINO ACIDS | PLEXXIKON, INC. (US) | 2010-11-11 | — | — | WO | disclosed |