Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 11/20 | 0.45 |
| ▸ | IL1B | P01584 | 7/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30108798 | 1.00 | NLRP3 (0.45) | NLRP3IL1BCHEK2ALDH1A1 | |
| SCHEMBL25864148 | 0.91 | NLRP3 (0.44) | NLRP3IL1BCHEK2ALDH1A1 | |
| SCHEMBL30108709 | 0.90 | NLRP3 (0.46) | NLRP3IL1BCHEK2ALDH1A1 | |
| SCHEMBL28934482 | 0.84 | NLRP3 (0.62) | NLRP3IL1B | |
| SCHEMBL30108648 | 0.84 | NLRP3 (0.62) | NLRP3IL1B | |
| SCHEMBL30214066 | 0.84 | IL1B (0.56) | NLRP3IL1BCHEK2 | |
| SCHEMBL30213998 | 0.84 | IL1B (0.56) | NLRP3IL1BCHEK2 | |
| SCHEMBL28934477 | 0.84 | NLRP3 (0.62) | NLRP3IL1B | |
| SCHEMBL28934292 | 0.84 | NLRP3 (0.48) | NLRP3IL1BCHEK2 | |
| SCHEMBL28934295 | 0.84 | NLRP3 (0.48) | NLRP3IL1BCHEK2 |
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-115433163-A | NLRP3 inflammasome inhibitor and application thereof | 药捷安康(南京)科技股份有限公司 | 2022-12-06 | — | — | CN | disclosed |