Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 4/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 6/20 | 0.36 |
| ▸ | WDR77 | Q9BQA1 | 6/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CCKBR | P32239 | 1/20 | 0.35 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.35 |
| ▸ | BTK | Q06187 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19085993 | 0.90 | BTK (0.38) | ROCK2ROCK1PRMT5WDR77ALDH1A1 | |
| SCHEMBL19086144 | 0.90 | ROCK2 (0.35) | ROCK2ROCK1PRMT5WDR77KDM4E | |
| SCHEMBL19085987 | 0.88 | KDM1A (0.41) | ROCK2ROCK1PRMT5WDR77ALDH1A1 | |
| SCHEMBL19086146 | 0.88 | ROCK2 (0.35) | ROCK2ROCK1PRMT5WDR77DDR1 | |
| SCHEMBL19085981 | 0.87 | TRPV1 (0.41) | ROCK2ROCK1PRMT5WDR77DDR1 | |
| SCHEMBL19085999 | 0.87 | TRPV1 (0.41) | ROCK2ROCK1PRMT5WDR77DDR1 | |
| SCHEMBL19086004 | 0.86 | PRMT5 (0.39) | ROCK2ROCK1PRMT5WDR77 | |
| SCHEMBL19085989 | 0.85 | MAOB (0.41) | ROCK2ROCK1 | |
| SCHEMBL19085978 | 0.85 | ROCK2 (0.46) | ROCK2ROCK1PRMT5WDR77TRPV1 | |
| SCHEMBL19086160 | 0.84 | HDAC6 (0.38) | ROCK2ROCK1PRMT5WDR77 |
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 |