Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 9/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | GBA1 | P04062 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28934427 | 1.00 | NLRP3 (0.47) | NLRP3KDM4EHSD17B10GBA1KMT2A | |
| SCHEMBL28934430 | 1.00 | NLRP3 (0.47) | NLRP3KDM4EHSD17B10GBA1KMT2A | |
| SCHEMBL25302312 | 0.90 | KDM4E (0.41) | NLRP3KDM4EHSD17B10GBA1KMT2A | |
| SCHEMBL30488599 | 0.90 | KDM4E (0.41) | NLRP3KDM4EHSD17B10GBA1KMT2A | |
| SCHEMBL25302310 | 0.90 | KDM4E (0.41) | NLRP3KDM4EHSD17B10GBA1KMT2A | |
| SCHEMBL25256486 | 0.84 | KDM4E (0.38) | NLRP3KDM4EHSD17B10GBA1KMT2A | |
| SCHEMBL25305252 | 0.84 | KDM4E (0.38) | NLRP3KDM4EHSD17B10GBA1KMT2A | |
| SCHEMBL30488554 | 0.84 | KDM4E (0.38) | NLRP3KDM4EHSD17B10GBA1KMT2A | |
| SCHEMBL30108801 | 0.83 | NLRP3 (0.47) | NLRP3IRAK4 | |
| SCHEMBL28934503 | 0.83 | NLRP3 (0.47) | NLRP3IRAK4 |
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 |