Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | TNIK | Q9UKE5 | 5/20 | 0.46 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.46 |
| ▸ | BRAF | P15056 | 3/20 | 0.44 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CLK1 | P49759 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL298879 | 0.99 | CYP2C9 (0.49) | CYP2C9CYP2C19TNIKMAP2K4BRAF | |
| SCHEMBL298881 | 0.92 | CAMKK2 (0.48) | CYP2C9CYP2C19MAP2K4BRAFPAK1 | |
| SCHEMBL298205 | 0.91 | CAMKK2 (0.49) | CYP2C9CYP2C19BRAFPAK1PIK3CA | |
| SCHEMBL10247915 | 0.90 | MAP2K4 (0.43) | CYP2C9CYP2C19MAP2K4BRAFPAK1 | |
| SCHEMBL297360 | 0.90 | CYP2C9 (0.56) | CYP2C9CYP2C19TNIKBRAFPIK3CA | |
| SCHEMBL10246625 | 0.89 | BRAF (0.42) | CYP2C9CYP2C19MAP2K4BRAFPAK1 | |
| SCHEMBL10246345 | 0.89 | CYP2C19 (0.43) | CYP2C9CYP2C19MAP2K4BRAFPAK1 | |
| SCHEMBL10246332 | 0.87 | PAK1 (0.41) | CYP2C9CYP2C19MAP2K4BRAFPAK1 | |
| SCHEMBL298226 | 0.85 | PAK1 (0.51) | CYP2C19BRAFPAK1CYP3A4 | |
| SCHEMBL299603 | 0.84 | CYP2C9 (0.53) | CYP2C9CYP2C19TNIKBRAFCYP2D6 |
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 |