Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 11/20 | 0.48 |
| ▸ | IL1B | P01584 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.36 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25299893 | 0.90 | NLRP3 (0.49) | NLRP3IL1BKDM4EHSD17B10ROCK2 | |
| SCHEMBL30488476 | 0.90 | NLRP3 (0.49) | NLRP3IL1BKDM4EHSD17B10ROCK2 | |
| SCHEMBL25299892 | 0.90 | NLRP3 (0.49) | NLRP3IL1BKDM4EHSD17B10ROCK2 | |
| SCHEMBL25302475 | 0.88 | NLRP3 (0.46) | NLRP3IL1BKDM4EHSD17B10ROCK2 | |
| SCHEMBL25302478 | 0.88 | NLRP3 (0.46) | NLRP3IL1BKDM4EHSD17B10ROCK2 | |
| SCHEMBL30488518 | 0.87 | NLRP3 (0.62) | NLRP3IL1B | |
| SCHEMBL25297240 | 0.87 | NLRP3 (0.62) | NLRP3IL1B | |
| SCHEMBL25256054 | 0.87 | NLRP3 (0.62) | NLRP3IL1B | |
| Hydrochloric Acid SCHEMBL25254453 | 0.87 | NLRP3 (0.46) | NLRP3IL1BKDM4EHSD17B10ROCK2 | |
| Hydrochloric Acid SCHEMBL25302155 | 0.87 | NLRP3 (0.46) | NLRP3IL1BKDM4EHSD17B10ROCK2 |
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 |