Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3C3 | Q8NEB9 | 6/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.47 |
| ▸ | AAK1 | Q2M2I8 | 6/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.42 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.40 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20765313 | 1.00 | PIK3C3 (0.48) | PIK3C3CYP3A4AAK1CYP1A2ALDH1A1 | |
| SCHEMBL20782557 | 0.93 | PIK3C3 (0.48) | PIK3C3CYP3A4AAK1CYP1A2ALDH1A1 | |
| SCHEMBL30514776 | 0.92 | AAK1 (0.48) | PIK3C3CYP3A4AAK1KMO | |
| SCHEMBL20764773 | 0.92 | AAK1 (0.48) | PIK3C3CYP3A4AAK1KMO | |
| SCHEMBL20782282 | 0.90 | PIK3C3 (0.61) | PIK3C3CYP3A4AAK1CYP1A2ALDH1A1 | |
| SCHEMBL30514774 | 0.90 | PIK3C3 (0.61) | PIK3C3CYP3A4AAK1CYP1A2ALDH1A1 | |
| SCHEMBL30514765 | 0.88 | TGFBR1 (0.43) | PIK3C3CYP3A4AAK1ADORA3TGFBR1 | |
| SCHEMBL20765601 | 0.88 | TGFBR1 (0.43) | PIK3C3CYP3A4AAK1ADORA3TGFBR1 | |
| SCHEMBL20764792 | 0.88 | AAK1 (0.49) | PIK3C3CYP3A4AAK1TGFBR1 | |
| SCHEMBL20782477 | 0.85 | PIK3C3 (0.46) | PIK3C3CYP3A4AAK1TGFBR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116903526-A | Pyridinylpyridinone compounds | 思普瑞特生物科学公司 | 2023-10-20 | — | — | CN | disclosed |
| CN-116891431-A | Pyridinylpyridinone compounds | 思普瑞特生物科学公司 | 2023-10-17 | — | — | CN | disclosed |
| CN-111094244-B | Pyridinylpyridinone compounds | 思普瑞特生物科学公司 | 2023-07-11 | — | — | CN | disclosed |