Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | PRKACA | P17612 | 1/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.39 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.39 |
| ▸ | EEF2K | O00418 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | CLK2 | P49760 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | PRKX | P51817 | 1/20 | 0.36 |
| ▸ | NEK4 | P51957 | 1/20 | 0.36 |
| ▸ | PRKG2 | Q13237 | 1/20 | 0.36 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.36 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | PBK | Q96KB5 | 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 | |
|---|---|---|---|---|
| SCHEMBL25395149 | 1.00 | ELANE (0.39) | ELANEROCK2ROCK1CHEK2PRKACA | |
| SCHEMBL24427867 | 0.84 | ELANE (0.39) | ELANEROCK2ROCK1CHEK2PRKACA | |
| SCHEMBL3614409 | 0.83 | KMT2A (0.40) | ELANEROCK2ROCK1CHEK2PRKACA | |
| SCHEMBL30376133 | 0.81 | NPC1 (0.46) | ELANEMAP2K4NPC1RAB9AEGFR | |
| SCHEMBL17632197 | 0.81 | NPC1 (0.46) | ELANEMAP2K4NPC1RAB9AEGFR | |
| SCHEMBL21986704 | 0.81 | ELANE (0.37) | ELANEROCK2ROCK1CHEK2PRKACA | |
| SCHEMBL23043526 | 0.80 | ELANE (0.40) | ELANEROCK2ROCK1CHEK2PRKACA | |
| SCHEMBL31106018 | 0.79 | ROCK2 (0.41) | ELANEROCK2ROCK1CHEK2PRKACA | |
| SCHEMBL3695671 | 0.78 | KMT2A (0.46) | ELANEROCK2ROCK1CHEK2PRKACA | |
| SCHEMBL12361357 | 0.78 | ROCK2 (0.35) | ELANEROCK2ROCK1CHEK2PRKACA |
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 |
|---|---|---|---|---|---|---|---|
| CN-118369323-A | Heterocyclic compounds as SHP2 inhibitors, compositions comprising the same, and methods of use thereof | 捷思英达控股有限公司 | 2024-07-19 | — | — | CN | disclosed |