Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 2/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 5/20 | 0.43 |
| ▸ | MKNK2 | Q9HBH9 | 5/20 | 0.43 |
| ▸ | MELK | Q14680 | 2/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 6/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 2/20 | 0.36 |
| ▸ | TYRO3 | Q06418 | 2/20 | 0.36 |
| ▸ | MERTK | Q12866 | 2/20 | 0.36 |
| ▸ | GAS6 | Q14393 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23837023 | 0.87 | MKNK1 (0.41) | MKNK1MKNK2MELKMAP4K4 | |
| SCHEMBL22013239 | 0.87 | MKNK1 (0.41) | MKNK1MKNK2MELKMAP4K4 | |
| SCHEMBL28218573 | 0.80 | MELK (0.61) | MAPK8MELKMAP4K4CYP2D6CYP2C19 | |
| SCHEMBL28218572 | 0.80 | MELK (0.61) | MAPK8MELKMAP4K4CYP2D6CYP2C19 | |
| SCHEMBL22013170 | 0.77 | NTRK1 (0.53) | — | |
| SCHEMBL23825253 | 0.77 | NTRK1 (0.53) | — | |
| SCHEMBL29692819 | 0.77 | NTRK1 (0.53) | — | |
| SCHEMBL22014119 | 0.76 | MAP4K4 (0.41) | MELKMAP4K4 | |
| SCHEMBL23837076 | 0.76 | MAP4K4 (0.41) | MELKMAP4K4 | |
| SCHEMBL23837044 | 0.75 | MAP4K4 (0.50) | MELKMAP4K4 |
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-3882247-A1 | SIX-MEMBERED AND SIX-MEMBERED HETEROCYCLIC COMPOUND AND USES THEREOF SERVING AS PROTEIN RECEPTOR KINASE INHIBITOR | Shanghai Ennovabio Pharmaceuticals Co., Ltd. (CN) | 2021-09-22 | — | — | EP | disclosed |
| WO-2020098723-A1 | SIX-MEMBERED AND SIX-MEMBERED HETEROCYCLIC COMPOUND AND USES THEREOF SERVING AS PROTEIN RECEPTOR KINASE INHIBITOR | 上海轶诺药业有限公司 | 2020-05-22 | — | — | WO | disclosed |