Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 12/20 | 0.45 |
| ▸ | IL1B | P01584 | 6/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | TNF | P01375 | 1/20 | 0.39 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL31057098 | 0.88 | IL1B (0.43) | NLRP3IL1BKCNH2TNFROCK2 | |
| SCHEMBL25304051 | 0.87 | IL1B (0.48) | NLRP3IL1BKCNH2TNF | |
| SCHEMBL29030489 | 0.87 | IL1B (0.48) | NLRP3IL1BKCNH2TNF | |
| SCHEMBL25519368 | 0.84 | NLRP3 (0.57) | NLRP3IL1BKCNH2TNF | |
| SCHEMBL30517832 | 0.84 | NLRP3 (0.57) | NLRP3IL1BKCNH2TNF | |
| SCHEMBL31057370 | 0.83 | IL1B (0.44) | NLRP3IL1BKCNH2TNF | |
| SCHEMBL31197249 | 0.83 | IL1B (0.46) | NLRP3IL1BKCNH2TNF | |
| SCHEMBL31057334 | 0.82 | IL1B (0.43) | NLRP3IL1BKCNH2TNF | |
| SCHEMBL31057134 | 0.81 | IL1B (0.43) | NLRP3IL1BKCNH2TNF | |
| SCHEMBL25254731 | 0.81 | NLRP3 (0.55) | NLRP3IL1BKCNH2TNF |
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 |