Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 5/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.36 |
| ▸ | WDR77 | Q9BQA1 | 2/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | DDR1 | Q08345 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | METTL3 | Q86U44 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19086145 | 0.90 | ROCK2 (0.36) | BTKMAPTALDH1A1ROCK2PRMT5 | |
| SCHEMBL19085987 | 0.90 | KDM1A (0.41) | ALDH1A1ROCK2NPC1RAB9APRMT5 | |
| SCHEMBL19086004 | 0.89 | PRMT5 (0.39) | ROCK2NPC1RAB9APRMT5WDR77 | |
| SCHEMBL19086258 | 0.89 | ROCK2 (0.34) | BTKROCK2PRMT5WDR77ROCK1 | |
| SCHEMBL19085999 | 0.88 | TRPV1 (0.41) | KMT2AROCK2NPC1RAB9APRMT5 | |
| SCHEMBL19085981 | 0.88 | TRPV1 (0.41) | KMT2AROCK2NPC1RAB9APRMT5 | |
| SCHEMBL19086146 | 0.87 | ROCK2 (0.35) | BTKROCK2PRMT5WDR77ROCK1 | |
| SCHEMBL19085989 | 0.86 | MAOB (0.41) | ROCK2NPC1RAB9AROCK1 | |
| SCHEMBL19085978 | 0.86 | ROCK2 (0.46) | ROCK2NPC1RAB9APRMT5WDR77 | |
| SCHEMBL19086144 | 0.86 | ROCK2 (0.35) | MAPTROCK2PRMT5WDR77ROCK1 |
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 |