Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 20/20 | 0.70 |
| ▸ | ADORA2B | P29275 | 20/20 | 0.70 |
| ▸ | ADORA1 | P30542 | 20/20 | 0.70 |
| ▸ | ADORA3 | P0DMS8 | 19/20 | 0.70 |
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 | |
|---|---|---|---|---|
| SCHEMBL13707375 | 0.83 | ADORA2A (0.77) | ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL4047556 | 0.82 | ADORA2A (0.72) | ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL4047512 | 0.82 | ADORA2A (0.78) | ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL4049226 | 0.82 | ADORA2A (1.00) | ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL13322071 | 0.81 | ADORA2A (0.86) | ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL4045229 | 0.81 | ADORA2A (1.00) | ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL4045493 | 0.81 | ADORA2A (0.85) | ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL4048865 | 0.81 | ADORA2A (0.84) | ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL4051359 | 0.81 | ADORA2A (1.00) | ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL4047180 | 0.81 | ADORA2A (1.00) | ADORA2AADORA2BADORA1ADORA3 |
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 |
|---|---|---|---|---|---|---|---|
| US-7141575-B2 | Triazolo[4,5-d]pyrimidine derivatives and their use as purinergic receptor antagonists | VERNALIS RESEARCH LTD. (GB) | 2006-11-28 | — | — | US | disclosed |