Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.34 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 3/20 | 0.32 |
| ▸ | MPO | P05164 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | PI4KA | P42356 | 1/20 | 0.30 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.30 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.30 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12427508 | 0.80 | AADAT (0.37) | AADATADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL28047375 | 0.78 | ADORA2A (0.37) | AADATADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL29126055 | 0.77 | APP (0.32) | — | |
| SCHEMBL29126059 | 0.77 | APP (0.32) | — | |
| SCHEMBL26782831 | 0.77 | HPGD (0.40) | AADATBTKACHEHPGD | |
| SCHEMBL25719671 | 0.76 | AADAT (0.38) | AADATADORA2ABTKACHEMPO | |
| SCHEMBL12800678 | 0.75 | BTK (0.43) | AADATADORA2AADORA1BTKACHE | |
| SCHEMBL27229314 | 0.74 | AADAT (0.37) | AADATBTKPI4KB | |
| SCHEMBL28241591 | 0.74 | BTK (0.51) | AADATBTKACHE | |
| SCHEMBL17047825 | 0.73 | AADAT (0.39) | AADATADORA3ADORA2AADORA1ADORA2B |
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-118359542-A | Polysubstituted pyrazole compound and preparation method and application thereof | 甫康（上海）健康科技有限责任公司 | 2024-07-19 | — | — | CN | disclosed |