Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 4/20 | 0.41 |
| ▸ | MKNK2 | Q9HBH9 | 4/20 | 0.41 |
| ▸ | MELK | Q14680 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 7/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.35 |
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 | 1.00 | MKNK1 (0.41) | MKNK1MKNK2MELKHRH4MAP4K4 | |
| SCHEMBL22013243 | 0.87 | MAPK8 (0.47) | MKNK1MKNK2MELKMAP4K4 | |
| SCHEMBL22013132 | 0.80 | MAP4K4 (0.39) | MELKMAP4K4PDE10AP2RX7 | |
| SCHEMBL22013104 | 0.79 | MELK (0.39) | MELKMAP4K4PDE10AP2RX7 | |
| SCHEMBL23837000 | 0.79 | MELK (0.38) | MELKMAP4K4PDE10AP2RX7 | |
| SCHEMBL23836947 | 0.79 | MELK (0.39) | MELKMAP4K4PDE10AP2RX7 | |
| SCHEMBL22013059 | 0.76 | NTRK1 (0.40) | MKNK1MKNK2 | |
| SCHEMBL29692794 | 0.76 | NTRK1 (0.40) | MKNK1MKNK2 | |
| SCHEMBL23836964 | 0.76 | MAP4K4 (0.37) | MELKMAP4K4PDE10AP2RX7 | |
| SCHEMBL23837065 | 0.76 | MAP4K4 (0.37) | MELKMAP4K4PDE10AP2RX7 |
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 |