Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 15/20 | 0.56 |
| ▸ | IL1B | P01584 | 4/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28934393 | 1.00 | NLRP3 (0.56) | NLRP3IL1BPIK3CDROCK2 | |
| SCHEMBL28934388 | 1.00 | NLRP3 (0.56) | NLRP3IL1BPIK3CDROCK2 | |
| SCHEMBL25299892 | 0.91 | NLRP3 (0.49) | NLRP3IL1BPIK3CDROCK2 | |
| SCHEMBL30488476 | 0.91 | NLRP3 (0.49) | NLRP3IL1BPIK3CDROCK2 | |
| SCHEMBL25299893 | 0.91 | NLRP3 (0.49) | NLRP3IL1BPIK3CDROCK2 | |
| SCHEMBL29030524 | 0.90 | NLRP3 (0.49) | NLRP3IL1BPIK3CD | |
| SCHEMBL25856517 | 0.90 | NLRP3 (0.49) | NLRP3IL1BPIK3CD | |
| SCHEMBL30101041 | 0.88 | NLRP3 (0.57) | NLRP3IL1BROCK2 | |
| SCHEMBL28934618 | 0.88 | NLRP3 (0.57) | NLRP3IL1BROCK2 | |
| SCHEMBL28934619 | 0.88 | NLRP3 (0.57) | NLRP3IL1BROCK2 |
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 |