Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL31495970 | 0.89 | BUB1 (0.33) | ALDH1A1 | |
| SCHEMBL31314273 | 0.87 | PDCD1 (0.30) | PDCD1CD274 | |
| SCHEMBL25858318 | 0.85 | ALDH1A1 (0.34) | ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL31495979 | 0.82 | BUB1 (0.34) | — | |
| SCHEMBL25859857 | 0.79 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL31314127 | 0.79 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL31495983 | 0.78 | HTR2C (0.35) | ALDH1A1POLB | |
| SCHEMBL30517866 | 0.77 | FLT3 (0.33) | — | |
| SCHEMBL31496010 | 0.77 | BUB1 (0.33) | — | |
| SCHEMBL31495952 | 0.77 | BUB1 (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2025036275-A1 | NLRP3 INFLAMMASOME INHIBITOR AND USE THEREOF | 药捷安康(南京)科技股份有限公司 | 2025-02-20 | — | — | WO | disclosed |
| CN-119462517-A | NLRP3 inflammation corpuscle inhibitor and application thereof | 药捷安康(南京)科技股份有限公司 | 2025-02-18 | — | — | CN | disclosed |