Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 6/20 | 0.38 |
| ▸ | IL1B | P01584 | 3/20 | 0.33 |
| ▸ | TNF | P01375 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25519380 | 0.85 | NLRP3 (0.50) | NLRP3IL1B | |
| SCHEMBL25859518 | 0.84 | NLRP3 (0.37) | NLRP3IL1BTNF | |
| SCHEMBL25856428 | 0.83 | NLRP3 (0.36) | NLRP3IL1BTNF | |
| SCHEMBL25859574 | 0.80 | NLRP3 (0.43) | NLRP3IL1BTNF | |
| SCHEMBL25856422 | 0.78 | ADORA2A (0.36) | NLRP3 | |
| SCHEMBL25864814 | 0.78 | NLRP3 (0.31) | NLRP3 | |
| SCHEMBL31496024 | 0.76 | CACNA2D1 (0.31) | — | |
| SCHEMBL26773007 | 0.75 | TRPA1 (0.44) | IL1B | |
| SCHEMBL31314157 | 0.74 | NLRP3 (0.32) | NLRP3 | |
| SCHEMBL25862674 | 0.73 | GRM5 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023131277-A1 | NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF | 药捷安康(南京)科技股份有限公司 | 2023-07-13 | — | — | WO | disclosed |