Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 1/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 12/20 | 0.38 |
| ▸ | CSF1R | P07333 | 12/20 | 0.38 |
| ▸ | LYN | P07948 | 12/20 | 0.38 |
| ▸ | SIK1 | P57059 | 12/20 | 0.38 |
| ▸ | SIK2 | Q9H0K1 | 12/20 | 0.38 |
| ▸ | SIK3 | Q9Y2K2 | 12/20 | 0.38 |
| ▸ | PRKAB2 | O43741 | 11/20 | 0.38 |
| ▸ | PRKAG1 | P54619 | 11/20 | 0.38 |
| ▸ | PRKAA1 | Q13131 | 11/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 10/20 | 0.38 |
| ▸ | TGFBR2 | P37173 | 9/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28777048 | 0.94 | LCK (0.45) | LCKROCK2ROCK1ABL1CSF1R | |
| SCHEMBL29674607 | 0.88 | ROCK2 (0.42) | LCKROCK2ROCK1NPC1ALDH1A1 | |
| SCHEMBL28777015 | 0.88 | ROCK2 (0.42) | LCKROCK2ROCK1NPC1ALDH1A1 | |
| SCHEMBL28777011 | 0.86 | ROCK2 (0.42) | LCKROCK2ROCK1KDRNPC1 | |
| SCHEMBL16637702 | 0.85 | ROCK2 (0.44) | ROCK2ROCK1KDRNPC1ALDH1A1 | |
| SCHEMBL16637704 | 0.82 | ROCK2 (0.65) | ROCK2ROCK1 | |
| SCHEMBL29674711 | 0.78 | MEN1 (0.43) | ROCK2ROCK1KDRNPC1ALDH1A1 | |
| SCHEMBL29674733 | 0.78 | MEN1 (0.43) | ROCK2ROCK1KDRNPC1ALDH1A1 | |
| SCHEMBL29674761 | 0.78 | ROCK2 (0.65) | LCKROCK2ROCK1 | |
| SCHEMBL29007158 | 0.78 | ROCK2 (0.65) | LCKROCK2ROCK1 |
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-114573566-B | Selective ROCK2 kinase inhibitors | 杭州邦顺制药有限公司 | 2023-05-30 | — | — | CN | disclosed |