Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | ACE | P12821 | 5/20 | 0.52 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.51 |
| ▸ | FKBP1A | P62942 | 4/20 | 0.50 |
| ▸ | PREP | P48147 | 3/20 | 0.50 |
| ▸ | REN | P00797 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.48 |
| ▸ | DPP4 | P27487 | 1/20 | 0.47 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.47 |
| ▸ | CTSL | P07711 | 1/20 | 0.47 |
| ▸ | CTSS | P25774 | 1/20 | 0.47 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.46 |
| ▸ | CMA1 | P23946 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL30769540 | 0.93 | ACE (0.61) | ALDH1A1CYP3A4TSHRACEPREP | |
| SCHEMBL18620591 | 0.88 | ACE (0.64) | ALDH1A1CYP3A4TSHRACEKLK5 | |
| SCHEMBL7303514 | 0.88 | ACE (0.64) | ALDH1A1CYP3A4TSHRACEKLK5 | |
| SCHEMBL31473162 | 0.86 | CTSK (0.45) | ALDH1A1CYP3A4TSHRACEKLK5 | |
| SCHEMBL2499034 | 0.86 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TSHRACEFKBP1A | |
| SCHEMBL20958585 | 0.85 | ADORA3 (0.54) | ALDH1A1CYP3A4TSHRACEKLK5 | |
| SCHEMBL14673533 | 0.85 | ADORA3 (0.54) | ALDH1A1CYP3A4TSHRACEKLK5 | |
| SCHEMBL14673534 | 0.85 | ADORA3 (0.54) | ALDH1A1CYP3A4TSHRACEKLK5 | |
| SCHEMBL14673535 | 0.85 | ADORA3 (0.54) | ALDH1A1CYP3A4TSHRACEKLK5 | |
| SCHEMBL12968535 | 0.85 | ALDH1A1 (0.60) | ALDH1A1CYP3A4TSHRACEKLK5 |
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-119403810-A | Compounds, pharmaceutical compositions containing them and their medical use for the treatment or prevention of vascular diseases | 瓦斯塞拉股份有限公司 | 2025-02-07 | — | — | CN | disclosed |