Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 18/20 | 0.67 |
| ▸ | ADORA1 | P30542 | 10/20 | 0.67 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.67 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22552123 | 0.89 | ADORA2A (0.67) | ADORA2AADORA1ADORA2BROCK2ROCK1 | |
| SCHEMBL29906746 | 0.89 | ADORA2A (0.67) | ADORA2AADORA1ADORA2BROCK2ROCK1 | |
| SCHEMBL21730174 | 0.85 | ADORA2A (0.70) | ADORA2AADORA1ADORA2BROCK2ROCK1 | |
| SCHEMBL29906702 | 0.85 | ADORA2A (0.70) | ADORA2AADORA1ADORA2BROCK2ROCK1 | |
| SCHEMBL22551981 | 0.85 | ADORA2A (0.77) | ADORA2AADORA1ADORA2B | |
| SCHEMBL29906680 | 0.84 | ADORA2A (0.63) | ADORA2AADORA1ADORA2BROCK2ROCK1 | |
| SCHEMBL22551871 | 0.84 | ADORA2A (0.63) | ADORA2AADORA1ADORA2BROCK2ROCK1 | |
| SCHEMBL29906692 | 0.83 | ADORA2A (0.83) | ADORA2AADORA1ADORA2B | |
| SCHEMBL22551955 | 0.83 | ADORA2A (0.83) | ADORA2AADORA1ADORA2B | |
| SCHEMBL21730250 | 0.82 | ADORA2A (0.60) | ADORA2AADORA1ADORA2BROCK2ROCK1 |
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-2020035052-A1 | PYRAZINE COMPOUNDS AND USES THEREOF | DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) | 2020-02-20 | — | — | WO | disclosed |