Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 15/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28516168 | 0.90 | NPSR1 (0.47) | NPSR1ADORA2AADORA1BACE1 | |
| SCHEMBL2032508 | 0.89 | NPSR1 (0.51) | NPSR1ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL12690863 | 0.84 | NPSR1 (0.47) | NPSR1ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL12642764 | 0.78 | NPSR1 (0.44) | NPSR1ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL20416581 | 0.78 | KDM4E (0.40) | NPSR1BACE1 | |
| SCHEMBL28529109 | 0.78 | NPSR1 (0.59) | NPSR1ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL23355599 | 0.78 | BACE1 (0.38) | NPSR1ADORA2AADORA1BACE1TACR1 | |
| SCHEMBL8260068 | 0.78 | MRGPRX4 (0.51) | ADORA2ABACE1 | |
| SCHEMBL20416847 | 0.78 | KCNH2 (0.39) | NPSR1ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL28524946 | 0.77 | VSIR (0.40) | NPSR1 |
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-112423758-A | Adenosine receptor binding compounds | 尼康治疗公司 | 2021-02-26 | — | — | CN | disclosed |