Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 14/20 | 1.00 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.64 |
| ▸ | NAMPT | P43490 | 2/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.50 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3810618 | 0.86 | ROCK2 (0.75) | ROCK2ROCK1ADORA3ADORA2AADORA2B | |
| SCHEMBL3132012 | 0.84 | ROCK2 (1.00) | ROCK2ROCK1NAMPTHIF1A | |
| SCHEMBL18254807 | 0.81 | ROCK2 (0.68) | ROCK2ROCK1ADORA3ADORA2AADORA2B | |
| SCHEMBL3127521 | 0.81 | ROCK2 (1.00) | ROCK2ROCK1NAMPTHIF1A | |
| SCHEMBL21768020 | 0.80 | ROCK2 (0.66) | ROCK2ROCK1 | |
| SCHEMBL1649591 | 0.78 | ROCK2 (1.00) | ROCK2ROCK1ADORA3ADORA2AADORA2B | |
| SCHEMBL3249431 | 0.78 | ROCK2 (1.00) | ROCK2ROCK1NAMPT | |
| SCHEMBL1647671 | 0.77 | ROCK2 (0.71) | ROCK2ROCK1ADORA3ADORA2AADORA2B | |
| SCHEMBL1648242 | 0.77 | ROCK2 (0.63) | ROCK2ROCK1ADORA3ADORA2AADORA2B | |
| SCHEMBL4926954 | 0.77 | ROCK2 (0.62) | ROCK2ROCK1ADORA3ADORA2AADORA2B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010036316-A1 | UREA AND CARBAMATE COMPOUNDS AND ANALOGS AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-04-01 | — | — | WO | claimed |
| EP-3464262-B1 | TRIAZOLONES AND TETRAZOLONES AS INHIBITORS OF ROCK | BRISTOL MYERS SQUIBB CO (US) | 2020-02-26 | — | — | EP | disclosed |
| WO-2010036316-A1 | UREA AND CARBAMATE COMPOUNDS AND ANALOGS AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-04-01 | — | — | WO | disclosed |