Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 9/20 | 0.51 |
| ▸ | JAK2 | O60674 | 7/20 | 0.43 |
| ▸ | JAK3 | P52333 | 7/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.41 |
| ▸ | IL1B | P01584 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30108776 | 1.00 | NLRP3 (0.51) | NLRP3JAK2JAK3ALDH1A1IRAK4 | |
| SCHEMBL28934539 | 1.00 | NLRP3 (0.51) | NLRP3JAK2JAK3ALDH1A1IRAK4 | |
| SCHEMBL28934545 | 0.91 | NLRP3 (0.49) | NLRP3JAK2ALDH1A1IRAK4IL1B | |
| SCHEMBL25864158 | 0.91 | NLRP3 (0.47) | NLRP3JAK2JAK3ALDH1A1IL1B | |
| SCHEMBL28934549 | 0.91 | NLRP3 (0.49) | NLRP3JAK2ALDH1A1IRAK4IL1B | |
| SCHEMBL30108648 | 0.87 | NLRP3 (0.62) | NLRP3IL1B | |
| SCHEMBL28934477 | 0.87 | NLRP3 (0.62) | NLRP3IL1B | |
| SCHEMBL28934482 | 0.87 | NLRP3 (0.62) | NLRP3IL1B | |
| SCHEMBL30108657 | 0.86 | NLRP3 (0.62) | NLRP3JAK2JAK3IRAK4IL1B | |
| SCHEMBL30108806 | 0.86 | NLRP3 (0.62) | NLRP3JAK2JAK3IRAK4IL1B |
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 |