Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BUB1 | O43683 | 3/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 11/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | LYN | P07948 | 1/20 | 0.33 |
| ▸ | TXK | P42681 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29218235 | 1.00 | BUB1 (0.38) | BUB1ROCK1MAPK14ROCK2RORC | |
| SCHEMBL30163037 | 0.87 | ROCK1 (0.36) | ROCK1RORCTRPV1GSK3BDYRK1A | |
| SCHEMBL29218173 | 0.87 | ROCK1 (0.36) | ROCK1RORCTRPV1GSK3BDYRK1A | |
| SCHEMBL29218162 | 0.86 | ROCK1 (0.40) | ROCK1 | |
| SCHEMBL30162925 | 0.86 | ROCK1 (0.40) | ROCK1 | |
| SCHEMBL30162996 | 0.82 | ROCK1 (0.41) | ROCK1ROCK2 | |
| SCHEMBL29218175 | 0.82 | ROCK1 (0.41) | ROCK1ROCK2 | |
| SCHEMBL30162787 | 0.81 | BUB1 (0.35) | BUB1MAPK14GSK3BDYRK1ALYN | |
| SCHEMBL29218186 | 0.81 | BUB1 (0.35) | BUB1MAPK14GSK3BDYRK1ALYN | |
| SCHEMBL30163175 | 0.77 | ROCK1 (0.37) | ROCK1ROCK2TRPV1GSK3BDYRK1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4377306-A1 | ROCK2 INHIBITORS AND USES THEREOF | President and Fellows of Harvard College (US) | 2024-06-05 | — | — | EP | disclosed |
| CN-118055926-A | ROCK2 inhibitors and uses thereof | 哈佛大学的校长及成员们 | 2024-05-17 | — | — | CN | disclosed |
| WO-2023009475-A1 | ROCK2 INHIBITORS AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-02-02 | — | — | WO | disclosed |