Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 20/20 | 0.62 |
| ▸ | ADORA1 | P30542 | 20/20 | 0.62 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL28505779 | 0.80 | ADORA2A (0.62) | ADORA2AADORA1ADORA2B | |
| SCHEMBL2326577 | 0.77 | ADORA2A (1.00) | ADORA2AADORA1ADORA2B | |
| SCHEMBL2320952 | 0.76 | ADORA2A (0.71) | ADORA2AADORA1ADORA2B | |
| SCHEMBL2327399 | 0.75 | ADORA2A (1.00) | ADORA2AADORA1ADORA2B | |
| SCHEMBL2321052 | 0.75 | ADORA2A (1.00) | ADORA2AADORA1ADORA2B | |
| SCHEMBL2324215 | 0.74 | ADORA2A (1.00) | ADORA2AADORA1ADORA2B | |
| SCHEMBL30186658 | 0.74 | ADORA2A (1.00) | ADORA2AADORA1ADORA2B | |
| SCHEMBL2322225 | 0.74 | ADORA1 (0.68) | ADORA2AADORA1ADORA2B | |
| SCHEMBL2320502 | 0.72 | ADORA2A (0.71) | ADORA2AADORA1ADORA2B | |
| SCHEMBL23468232 | 0.71 | ADORA2A (0.54) | ADORA2AADORA1ADORA2B |
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-108467386-B | Fused heteroaryl substituted 1,2, 4-triazine-3-amine derivatives, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2020-11-17 | — | — | CN | disclosed |