Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 7/20 | 0.44 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.40 |
| ▸ | TYK2 | P29597 | 1/20 | 0.40 |
| ▸ | CLK2 | P49760 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | PRKCH | P24723 | 1/20 | 0.40 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.40 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.40 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.40 |
| ▸ | LATS1 | O95835 | 1/20 | 0.40 |
| ▸ | LATS2 | Q9NRM7 | 1/20 | 0.40 |
| ▸ | TRIM58 | Q8NG06 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17653264 | 0.90 | AAK1 (0.40) | AAK1LRRK2GSK3BJAK2ROCK2 | |
| SCHEMBL17653179 | 0.82 | AAK1 (0.62) | AAK1LRRK2GSK3BJAK2ROCK2 | |
| SCHEMBL17653203 | 0.80 | AAK1 (0.47) | AAK1LRRK2GSK3BCHEK1MKNK1 | |
| SCHEMBL17653250 | 0.79 | AAK1 (0.55) | AAK1LRRK2GSK3BKCNH2ATM | |
| SCHEMBL17653111 | 0.75 | AAK1 (0.59) | AAK1LRRK2GSK3BKCNH2ATM | |
| SCHEMBL19253018 | 0.75 | AAK1 (0.45) | AAK1LRRK2GSK3BJAK2ROCK2 | |
| SCHEMBL17653311 | 0.74 | AAK1 (0.60) | AAK1ROCK2MAP4K4TRIM58ALDH1A1 | |
| SCHEMBL17653269 | 0.71 | AAK1 (0.42) | AAK1GSK3BCHEK1MKNK1BMP2K | |
| SCHEMBL17663501 | 0.70 | AAK1 (0.59) | AAK1LRRK2GSK3BJAK2ROCK2 | |
| SCHEMBL4360601 | 0.70 | MAP4K4 (0.56) | MAP4K4CLK4CD38ALDH1A1HSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3200797-A1 | QUINAZOLINE-BASED KINASE INHIBITORS | Bristol-Myers Squibb Company (US) | 2017-08-09 | — | — | EP | disclosed |
| WO-2016053794-A1 | QUINAZOLINE-BASED KINASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2016-04-07 | — | — | WO | disclosed |