Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.37 |
| ▸ | PIKFYVE | Q9Y2I7 | 2/20 | 0.36 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 8/20 | 0.36 |
| ▸ | APP | P05067 | 2/20 | 0.36 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.35 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.33 |
| ▸ | HAO1 | Q9UJM8 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25859156 | 0.80 | CHRNB2 (0.37) | PIKFYVETBK1BACE1APP | |
| SCHEMBL24696097 | 0.79 | NLRP3 (0.42) | NLRP3 | |
| SCHEMBL25856422 | 0.79 | ADORA2A (0.36) | NLRP3 | |
| SCHEMBL25859161 | 0.75 | NLRP3 (0.46) | EGLN1NLRP3 | |
| SCHEMBL29030572 | 0.74 | IL1B (0.49) | NLRP3 | |
| SCHEMBL25856267 | 0.74 | IL1B (0.49) | NLRP3 | |
| SCHEMBL30488546 | 0.74 | IL1B (0.49) | NLRP3 | |
| SCHEMBL24695931 | 0.72 | ADORA2A (0.46) | NLRP3 | |
| SCHEMBL24695713 | 0.72 | ADORA2A (0.46) | — | |
| SCHEMBL24695420 | 0.69 | NLRP3 (0.53) | NLRP3 |
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 |