Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 6/20 | 0.36 |
| ▸ | IL1B | P01584 | 3/20 | 0.34 |
| ▸ | TNF | P01375 | 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 | |
|---|---|---|---|---|
| SCHEMBL25859518 | 0.87 | NLRP3 (0.37) | NLRP3IL1BTNF | |
| SCHEMBL25856432 | 0.83 | NLRP3 (0.38) | NLRP3IL1BTNF | |
| SCHEMBL25519380 | 0.83 | NLRP3 (0.50) | NLRP3IL1B | |
| SCHEMBL25859262 | 0.82 | IL1B (0.43) | NLRP3IL1BTNF | |
| SCHEMBL25856423 | 0.79 | NLRP3 (0.30) | NLRP3 | |
| SCHEMBL25861298 | 0.74 | KDM4E (0.41) | — | |
| SCHEMBL26773007 | 0.72 | TRPA1 (0.44) | IL1B | |
| SCHEMBL30833885 | 0.72 | IL1B (0.72) | NLRP3IL1BTNF | |
| SCHEMBL25857850 | 0.71 | NLRP3 (0.42) | NLRP3IL1BTNF | |
| SCHEMBL24575631 | 0.71 | SIRT3 (0.37) | IL1B |
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 |