Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 9/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | JAK2 | O60674 | 2/20 | 0.42 |
| ▸ | KDR | P35968 | 2/20 | 0.41 |
| ▸ | BTK | Q06187 | 2/20 | 0.40 |
| ▸ | PLK4 | O00444 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | PAK4 | O96013 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30163093 | 1.00 | ROCK2 (0.46) | ROCK2ROCK1NPC1RAB9AJAK2 | |
| SCHEMBL30163092 | 0.88 | ROCK2 (0.43) | ROCK2ROCK1NPC1RAB9AJAK2 | |
| SCHEMBL29218209 | 0.88 | ROCK2 (0.43) | ROCK2ROCK1NPC1RAB9AJAK2 | |
| SCHEMBL29218242 | 0.80 | RXRA (0.39) | ROCK1JAK2KDRABL1EGFR | |
| SCHEMBL30163099 | 0.80 | RXRA (0.39) | ROCK1JAK2KDRABL1EGFR | |
| SCHEMBL24934042 | 0.80 | ROCK2 (0.42) | ROCK2ROCK1NPC1RAB9AJAK2 | |
| SCHEMBL24934035 | 0.79 | ROCK2 (0.45) | ROCK2ROCK1NPC1RAB9AJAK2 | |
| SCHEMBL29218197 | 0.77 | ROCK2 (0.42) | ROCK2ROCK1NPC1RAB9AJAK2 | |
| SCHEMBL29218335 | 0.76 | ROCK1 (0.42) | ROCK1KDRABL1FGFR1MAPK1 | |
| SCHEMBL30162997 | 0.75 | NPC1 (0.46) | ROCK2ROCK1NPC1RAB9AJAK2 |
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-118055926-A | ROCK2 inhibitors and uses thereof | 哈佛大学的校长及成员们 | 2024-05-17 | — | — | CN | disclosed |