Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 20/20 | 0.56 |
| ▸ | ADORA1 | P30542 | 8/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL15845642 | 1.00 | ADORA2A (0.56) | ADORA2AADORA1KCNH2 | |
| SCHEMBL15845647 | 0.90 | ADORA2A (0.55) | ADORA2AADORA1KCNH2 | |
| SCHEMBL17897230 | 0.89 | ADORA2A (0.60) | ADORA2AADORA1KCNH2 | |
| SCHEMBL30427857 | 0.89 | ADORA2A (0.57) | ADORA2AADORA1KCNH2 | |
| SCHEMBL15845519 | 0.89 | ADORA2A (0.57) | ADORA2AADORA1KCNH2 | |
| SCHEMBL25418864 | 0.89 | ADORA2A (0.59) | ADORA2AADORA1KCNH2 | |
| SCHEMBL15845785 | 0.88 | ADORA2A (0.53) | ADORA2AADORA1KCNH2 | |
| SCHEMBL30427881 | 0.88 | ADORA2A (0.53) | ADORA2AADORA1KCNH2 | |
| SCHEMBL25212090 | 0.87 | ADORA2A (0.55) | ADORA2AADORA1KCNH2 | |
| SCHEMBL15845776 | 0.86 | ADORA2A (0.56) | ADORA2AADORA1KCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4185296-A1 | ADENOSINE A2A AND A2B RECEPTOR DUAL ANTAGONISTS FOR IMMUNO-ONCOLOGY | Merck Sharp & Dohme LLC (US) | 2023-05-31 | — | — | EP | disclosed |
| EP-4185297-A1 | ADENOSINE A2A AND A2B RECEPTOR DUAL ANTAGONISTS FOR IMMUNO-ONCOLOGY | Merck Sharp & Dohme LLC (US) | 2023-05-31 | — | — | EP | disclosed |