Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 16/20 | 0.45 |
| ▸ | IL1B | P01584 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KDM2B | Q8NHM5 | 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 | |
|---|---|---|---|---|
| SCHEMBL25258122 | 1.00 | NLRP3 (0.45) | NLRP3IL1BKDM4EALDH1A1KDM2B | |
| SCHEMBL30488507 | 1.00 | NLRP3 (0.45) | NLRP3IL1BKDM4EALDH1A1KDM2B | |
| SCHEMBL30833873 | 0.94 | NLRP3 (0.44) | NLRP3IL1B | |
| SCHEMBL30517812 | 0.86 | NLRP3 (0.51) | NLRP3IL1B | |
| SCHEMBL25303114 | 0.86 | NLRP3 (0.51) | NLRP3IL1B | |
| SCHEMBL25303108 | 0.86 | NLRP3 (0.51) | NLRP3IL1B | |
| SCHEMBL30488555 | 0.85 | IL1B (0.52) | NLRP3IL1B | |
| SCHEMBL25303351 | 0.85 | IL1B (0.52) | NLRP3IL1B | |
| SCHEMBL25303354 | 0.85 | IL1B (0.52) | NLRP3IL1B | |
| SCHEMBL30833920 | 0.82 | NLRP3 (0.40) | NLRP3IL1B |
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 3 patents. 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 |
| 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 |
| CN-116410140-A | NLRP3 inflammation corpuscle inhibitor and application thereof | 药捷安康(南京)科技股份有限公司 | 2023-07-11 | — | — | CN | disclosed |