Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METTL3 | Q86U44 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 5/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.37 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.36 |
| ▸ | WNT3A | P56704 | 3/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | VDR | P11473 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 3/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19086214 | 0.88 | METTL3 (0.48) | METTL3MAOBROCK2ROCK1ALDH1A1 | |
| SCHEMBL19086026 | 0.88 | METTL3 (0.44) | METTL3MAOBROCK2ROCK1ALDH1A1 | |
| SCHEMBL19086209 | 0.82 | ROCK2 (0.43) | METTL3MAOBROCK2ROCK1ALDH1A1 | |
| SCHEMBL19086995 | 0.82 | ROCK2 (0.47) | METTL3MAOBROCK2ROCK1ALDH1A1 | |
| SCHEMBL19086190 | 0.81 | ROCK2 (0.48) | METTL3ROCK2ROCK1KDM1AHDAC6 | |
| SCHEMBL19086230 | 0.80 | MAOB (0.44) | MAOBROCK2ROCK1 | |
| SCHEMBL19086217 | 0.80 | ROCK2 (0.43) | METTL3MAOBROCK2ROCK1KDM1A | |
| SCHEMBL19086183 | 0.79 | KDM1A (0.40) | METTL3MAOBROCK2ROCK1L3MBTL1 | |
| SCHEMBL19086024 | 0.79 | MAOB (0.43) | METTL3MAOBROCK2ROCK1ALDH1A1 | |
| SCHEMBL19086249 | 0.79 | ROCK2 (0.50) | METTL3ROCK2ROCK1HTTSMN1; SMN2 |
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 |