Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 5/20 | 0.35 |
| ▸ | P2RX2 | Q9UBL9 | 5/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | TTK | P33981 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.34 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30083021 | 0.84 | P2RX3 (0.38) | P2RX3P2RX2AURKATTKAURKB | |
| SCHEMBL28664582 | 0.82 | ALDH1A1 (0.35) | PIK3CARORCMAPT | |
| SCHEMBL30083014 | 0.82 | ALDH1A1 (0.35) | PIK3CARORCMAPT | |
| SCHEMBL29527631 | 0.75 | RORC (0.53) | P2RX3P2RX2PIK3R1PIK3CARORC | |
| SCHEMBL22959151 | 0.75 | RORC (0.53) | P2RX3P2RX2PIK3R1PIK3CARORC | |
| SCHEMBL24449953 | 0.74 | THRB (0.38) | P2RX3P2RX2PIK3R1PIK3CARORC | |
| SCHEMBL115578 | 0.73 | PIK3R1 (0.40) | P2RX3P2RX2AURKATTKAURKB | |
| SCHEMBL24449964 | 0.70 | RORC (0.46) | P2RX3P2RX2PIK3R1PIK3CARORC | |
| SCHEMBL11890406 | 0.70 | TSHR (0.43) | P2RX3P2RX2PIK3R1PIK3CARORC | |
| SCHEMBL30083006 | 0.69 | MAPT (0.32) | P2RX3P2RX2PIK3CAMAPT |
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-113698388-B | 6-oxo-1, 6-dihydropyridine derivative, preparation method and application thereof in medicine | 江苏恒瑞医药股份有限公司 | 2022-11-22 | — | — | CN | disclosed |