Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 19/20 | 0.50 |
| ▸ | ADORA2B | P29275 | 19/20 | 0.50 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29475899 | 0.79 | ADORA2A (0.46) | ADORA2AADORA2B | |
| SCHEMBL27164673 | 0.78 | ADORA2A (0.51) | ADORA2AADORA2B | |
| SCHEMBL27164710 | 0.77 | ADORA2A (0.48) | ADORA2AADORA2B | |
| SCHEMBL27164696 | 0.77 | ADORA2A (0.47) | ADORA2AADORA2B | |
| SCHEMBL25418823 | 0.76 | ADORA2A (0.49) | ADORA2AADORA2B | |
| SCHEMBL25418821 | 0.76 | ADORA2A (0.49) | ADORA2AADORA2B | |
| SCHEMBL25423986 | 0.76 | ADORA2A (0.49) | ADORA2AADORA2B | |
| SCHEMBL30427984 | 0.76 | ADORA2A (0.49) | ADORA2AADORA2B | |
| SCHEMBL26330309 | 0.76 | PDE10A (0.47) | ADORA2AADORA2BPDE10A | |
| SCHEMBL21996552 | 0.74 | ADORA2A (0.67) | ADORA2AADORA2B |
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-2023158626-A1 | ADENOSINE RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS AND THEIR USE THEREOF | MERCK SHARP & DOHME LLC (US) | 2023-08-24 | — | — | WO | disclosed |