Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 5/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 4/20 | 0.41 |
| ▸ | METTL3 | Q86U44 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.37 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19086190 | 0.93 | ROCK2 (0.48) | ROCK2ROCK1HDAC6MAPK14KDM1A | |
| SCHEMBL19086249 | 0.91 | ROCK2 (0.50) | ROCK2ROCK1HDAC6MAPK14KDM1A | |
| SCHEMBL19086209 | 0.91 | ROCK2 (0.43) | ROCK2ROCK1HDAC6MAPK14KDM1A | |
| SCHEMBL19086217 | 0.90 | ROCK2 (0.43) | ROCK2ROCK1HDAC6MAPK14KDM1A | |
| SCHEMBL19086026 | 0.87 | METTL3 (0.44) | ROCK2ROCK1HDAC6KDM1AMETTL3 | |
| SCHEMBL19086047 | 0.84 | ROCK2 (0.44) | ROCK2ROCK1HDAC6NPC1RAB9A | |
| SCHEMBL19086198 | 0.84 | HDAC6 (0.38) | ROCK2ROCK1HDAC6KDM1AMETTL3 | |
| SCHEMBL19086020 | 0.83 | ROCK2 (0.44) | ROCK2ROCK1HDAC6NPC1RAB9A | |
| SCHEMBL19086045 | 0.83 | HDAC6 (0.43) | ROCK2ROCK1HDAC6NPC1RAB9A | |
| SCHEMBL19086214 | 0.83 | METTL3 (0.48) | ROCK2ROCK1MAPK14METTL3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017114275-A1 | COMPOUND FOR INHIBITING ROCK, PREPARATION METHOD AND USE OF SAME | 成都先导药物开发有限公司 | 2017-07-06 | — | — | WO | disclosed |