Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 4/20 | 0.47 |
| ▸ | MAOB | P27338 | 4/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.47 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4952866 | 0.89 | ADORA1 (0.42) | ADORA1MAOBADORA2AADORA2BMAOA | |
| SCHEMBL2536366 | 0.89 | ADORA1 (0.47) | ADORA1MAOBADORA2AADORA2BMAOA | |
| SCHEMBL2537627 | 0.87 | ADORA1 (0.57) | ADORA1MAOBADORA2AADORA2B | |
| SCHEMBL2542698 | 0.87 | ADORA1 (0.47) | ADORA1MAOBADORA2AADORA2B | |
| SCHEMBL2537641 | 0.87 | ADORA2A (0.46) | ADORA1MAOBADORA2AADORA2B | |
| SCHEMBL2537917 | 0.86 | ADORA1 (0.45) | ADORA1MAOBADORA2AADORA2B | |
| SCHEMBL2541481 | 0.86 | ADORA2A (0.49) | ADORA1MAOBADORA2AADORA2B | |
| SCHEMBL2535874 | 0.85 | ADORA1 (0.45) | ADORA1MAOBADORA2AADORA2B | |
| SCHEMBL2541195 | 0.85 | ADORA2A (0.52) | ADORA1MAOBADORA2AADORA2B | |
| SCHEMBL2541035 | 0.85 | ADORA1 (0.47) | ADORA1MAOBADORA2AADORA2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1939197-A1 | 8-ethinylxanthine derivatives as selective A2A receptor antagonists | SCHWARZ PHARMA AG (DE) | 2008-07-02 | — | — | EP | disclosed |