Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
| ▸ | IL1B | P01584 | 18/20 | 0.54 |
| ▸ | TNF | P01375 | 3/20 | 0.54 |
| ▸ | HCRTR1 | O43613 | 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 | |
|---|---|---|---|---|
| SCHEMBL26438896 | 0.91 | KCNH2 (0.52) | NLRP3KCNH2IL1BTNFHCRTR1 | |
| SCHEMBL26435322 | 0.89 | NLRP3 (0.44) | NLRP3KCNH2IL1BTNF | |
| SCHEMBL26435657 | 0.88 | NLRP3 (0.43) | NLRP3KCNH2IL1BTNF | |
| SCHEMBL26436140 | 0.88 | NLRP3 (0.62) | NLRP3KCNH2IL1BTNF | |
| SCHEMBL26438939 | 0.86 | NLRP3 (0.68) | NLRP3KCNH2IL1BTNFHCRTR1 | |
| SCHEMBL26093704 | 0.86 | NLRP3 (0.68) | NLRP3KCNH2IL1BTNFHCRTR1 | |
| SCHEMBL26435693 | 0.86 | NLRP3 (0.68) | NLRP3KCNH2IL1BTNFHCRTR1 | |
| SCHEMBL30375062 | 0.86 | NLRP3 (0.68) | NLRP3KCNH2IL1BTNFHCRTR1 | |
| SCHEMBL26437103 | 0.85 | NLRP3 (0.54) | NLRP3KCNH2IL1BTNFHCRTR1 | |
| SCHEMBL26435636 | 0.84 | IL1B (0.48) | IL1BTNF |
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 |