Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 8/20 | 0.44 |
| ▸ | IL1B | P01584 | 7/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.37 |
| ▸ | JAK3 | P52333 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | TNF | P01375 | 1/20 | 0.36 |
| ▸ | JUN | P05412 | 2/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL26436179 | 0.94 | NLRP3 (0.44) | NLRP3IL1BKCNH2BRD4TNF | |
| SCHEMBL26435345 | 0.93 | NLRP3 (0.44) | NLRP3IL1BKCNH2BRD4TNF | |
| SCHEMBL26435680 | 0.93 | NLRP3 (0.44) | NLRP3IL1BKCNH2BRD4TNF | |
| SCHEMBL26435649 | 0.90 | IL1B (0.54) | NLRP3IL1BKCNH2TNF | |
| SCHEMBL26435064 | 0.90 | NLRP3 (0.48) | NLRP3IL1BJAK2JAK3KCNH2 | |
| SCHEMBL26435886 | 0.88 | NLRP3 (0.49) | NLRP3IL1BJAK2JAK3JUN | |
| SCHEMBL26437133 | 0.88 | NLRP3 (0.46) | NLRP3JAK2JAK3JUNMAPK8 | |
| SCHEMBL26436176 | 0.87 | NLRP3 (0.44) | NLRP3IL1BKCNH2BRD4TNF | |
| SCHEMBL26436161 | 0.87 | NLRP3 (0.46) | NLRP3IL1BKCNH2BRD4TNF | |
| SCHEMBL26435656 | 0.85 | IL1B (0.56) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023066377-A1 | NITROGEN-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 索智生物科技（浙江）有限公司 | 2023-04-27 | — | — | WO | disclosed |