Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 18/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22304359 | 0.86 | ADORA2A (0.36) | ADORA2AADORA2BADORA1NISCH | |
| SCHEMBL22304529 | 0.82 | ADORA2A (0.38) | ADORA2AADORA2BADORA1NISCH | |
| SCHEMBL30080281 | 0.82 | ADORA2A (0.38) | ADORA2AADORA2BADORA1NISCH | |
| SCHEMBL30080613 | 0.79 | NISCH (0.39) | ADORA2AADORA2BADORA1NISCH | |
| SCHEMBL30114630 | 0.75 | ADORA2A (0.46) | ADORA2AADORA2BADORA1 | |
| SCHEMBL20436371 | 0.75 | ADORA2A (0.46) | ADORA2AADORA2BADORA1 | |
| SCHEMBL28628129 | 0.74 | ADORA2A (0.39) | ADORA2AADORA2BNISCH | |
| SCHEMBL30114734 | 0.74 | ADORA2A (0.39) | ADORA2AADORA2BNISCH | |
| SCHEMBL28636992 | 0.74 | NUDT1 (0.34) | ADORA2AADORA2BNISCH | |
| SCHEMBL30114810 | 0.74 | NUDT1 (0.34) | ADORA2AADORA2BNISCH |
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 |
|---|---|---|---|---|---|---|---|
| CN-112996783-B | 2-aminopyrimidine derivatives, preparation method and application thereof in medicines | 江苏恒瑞医药股份有限公司 | 2022-11-18 | — | — | CN | disclosed |
| CN-112996783-A | 2-aminopyrimidine derivatives, preparation method and application thereof in medicines | 江苏恒瑞医药股份有限公司 | 2021-06-18 | — | — | CN | disclosed |