Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 7/20 | 0.48 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.48 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.40 |
| ▸ | KDM1A | O60341 | 3/20 | 0.40 |
| ▸ | METTL3 | Q86U44 | 1/20 | 0.40 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | AXL | P30530 | 1/20 | 0.39 |
| ▸ | FLT4 | P35916 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 1/20 | 0.39 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.39 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.39 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19086249 | 0.93 | ROCK2 (0.50) | ROCK2ROCK1MAPK14HDAC6KDM1A | |
| SCHEMBL19086995 | 0.93 | ROCK2 (0.47) | ROCK2ROCK1MAPK14HDAC6KDM1A | |
| SCHEMBL19086209 | 0.90 | ROCK2 (0.43) | ROCK2ROCK1MAPK14HDAC6KDM1A | |
| SCHEMBL19086217 | 0.89 | ROCK2 (0.43) | ROCK2ROCK1MAPK14HDAC6KDM1A | |
| SCHEMBL19086026 | 0.88 | METTL3 (0.44) | ROCK2ROCK1HDAC6KDM1AMETTL3 | |
| SCHEMBL19086198 | 0.87 | HDAC6 (0.38) | ROCK2ROCK1HDAC6KDM1AMETTL3 | |
| SCHEMBL19086052 | 0.85 | ROCK2 (0.46) | ROCK2ROCK1MAPK14HDAC6DCLK1 | |
| SCHEMBL19086214 | 0.84 | METTL3 (0.48) | ROCK2ROCK1MAPK14METTL3 | |
| SCHEMBL19086053 | 0.82 | ROCK2 (0.43) | ROCK2ROCK1MAPK14HDAC6DCLK1 | |
| SCHEMBL19086185 | 0.81 | METTL3 (0.43) | ROCK2ROCK1HDAC6KDM1AMETTL3 |
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 |