Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 11/20 | 0.49 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | IL1B | P01584 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28934549 | 1.00 | NLRP3 (0.49) | NLRP3IRAK4ALDH1A1IL1BCYP11B1 | |
| SCHEMBL25864163 | 0.91 | NLRP3 (0.45) | NLRP3ALDH1A1IL1BCYP11B1CYP11B2 | |
| SCHEMBL28934539 | 0.91 | NLRP3 (0.51) | NLRP3IRAK4ALDH1A1IL1BJAK2 | |
| SCHEMBL30108776 | 0.91 | NLRP3 (0.51) | NLRP3IRAK4ALDH1A1IL1BJAK2 | |
| SCHEMBL28934535 | 0.91 | NLRP3 (0.51) | NLRP3IRAK4ALDH1A1IL1BJAK2 | |
| SCHEMBL30108648 | 0.85 | NLRP3 (0.62) | NLRP3IL1B | |
| SCHEMBL28934482 | 0.85 | NLRP3 (0.62) | NLRP3IL1B | |
| SCHEMBL28934477 | 0.85 | NLRP3 (0.62) | NLRP3IL1B | |
| SCHEMBL28934737 | 0.84 | NLRP3 (0.50) | NLRP3IRAK4IL1BKDM4EHSD17B10 | |
| SCHEMBL28934734 | 0.84 | NLRP3 (0.50) | NLRP3IRAK4IL1BKDM4EHSD17B10 |
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 |