Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 17/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 15/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29616973 | 0.85 | ADORA2A (0.48) | ADORA2AADORA1ADORA3ADORA2BHDAC1 | |
| SCHEMBL23388322 | 0.85 | ADORA2A (0.48) | ADORA2AADORA1ADORA3ADORA2BHDAC1 | |
| SCHEMBL29031953 | 0.84 | ADORA2A (0.52) | ADORA2AADORA1HDAC1HSP90AA1TRAP1 | |
| SCHEMBL29617002 | 0.83 | ADORA2A (0.44) | ADORA2AADORA1ADORA3ADORA2BHDAC1 | |
| SCHEMBL23388284 | 0.83 | ADORA2A (0.44) | ADORA2AADORA1ADORA3ADORA2BHDAC1 | |
| SCHEMBL29616994 | 0.83 | ADORA2A (0.44) | ADORA2AADORA1ADORA3ADORA2BHDAC1 | |
| SCHEMBL29031965 | 0.82 | ADORA2A (0.62) | ADORA2AADORA1ADORA3ADORA2BHDAC1 | |
| SCHEMBL23388312 | 0.81 | ADORA2A (0.48) | ADORA2AADORA1ADORA3ADORA2BHDAC1 | |
| SCHEMBL29617020 | 0.81 | ADORA2A (0.48) | ADORA2AADORA1ADORA3ADORA2BHDAC1 | |
| SCHEMBL29617022 | 0.81 | ADORA2A (0.48) | ADORA2AADORA1ADORA3ADORA2BHDAC1 |
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-116425756-A | Adenosine receptor antagonist compounds and uses thereof | 日东制药株式会社 | 2023-07-14 | — | — | CN | disclosed |