Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 5/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.45 |
| ▸ | MYLK4 | Q86YV6 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | PAK4 | O96013 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | RET | P07949 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | FLT1 | P17948 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23109894 | 0.85 | ROCK2 (0.64) | ROCK2ROCK1MYLK4 | |
| SCHEMBL23501330 | 0.85 | ROCK2 (0.64) | ROCK2ROCK1MYLK4 | |
| SCHEMBL23522327 | 0.82 | ROCK2 (0.53) | ROCK2ROCK1RAB9ALMNAKMT2A | |
| SCHEMBL23501264 | 0.82 | ROCK2 (0.48) | ROCK2ROCK1MYLK4CHEK1AURKA | |
| SCHEMBL23501263 | 0.82 | ROCK2 (0.48) | ROCK2ROCK1MYLK4CHEK1AURKA | |
| SCHEMBL28401817 | 0.81 | ROCK2 (0.50) | ROCK2ROCK1MYLK4CHEK1AURKA | |
| SCHEMBL28577772 | 0.81 | ROCK2 (0.50) | ROCK2ROCK1MYLK4CHEK1AURKA | |
| SCHEMBL23522334 | 0.81 | RAB9A (0.42) | ROCK2RAB9AMAPK1LMNAXBP1 | |
| SCHEMBL23927679 | 0.80 | ROCK2 (0.44) | ROCK2ROCK1MYLK4NAMPT | |
| SCHEMBL23927684 | 0.80 | ROCK2 (0.44) | ROCK2ROCK1MYLK4NAMPT |
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-112979675-B | Small molecular sulfur-containing heterocyclic compound | 维眸生物科技（上海）有限公司 | 2023-12-19 | — | — | CN | disclosed |