Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 5/20 | 0.53 |
| ▸ | IL1B | P01584 | 12/20 | 0.49 |
| ▸ | TNF | P01375 | 3/20 | 0.49 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL26133230 | 1.00 | NLRP3 (0.53) | NLRP3IL1BTNFGRIN2BKCNH2 | |
| SCHEMBL30374880 | 1.00 | NLRP3 (0.53) | NLRP3IL1BTNFGRIN2BKCNH2 | |
| SCHEMBL26437004 | 0.93 | NLRP3 (0.52) | NLRP3IL1BTNFGRIN2BKCNH2 | |
| SCHEMBL26441653 | 0.86 | NLRP3 (0.55) | NLRP3IL1BTNFKCNH2 | |
| SCHEMBL26438470 | 0.86 | NLRP3 (0.55) | NLRP3IL1BTNFKCNH2 | |
| SCHEMBL26093229 | 0.86 | NLRP3 (0.55) | NLRP3IL1BTNFKCNH2 | |
| SCHEMBL26437567 | 0.84 | IL1B (0.57) | NLRP3IL1BTNFKCNH2 | |
| SCHEMBL26436327 | 0.84 | NLRP3 (0.52) | NLRP3IL1BTNFKCNH2SCN9A | |
| SCHEMBL31072351 | 0.83 | NLRP3 (0.54) | NLRP3IL1BTNFKCNH2SCN9A | |
| SCHEMBL26437758 | 0.83 | NLRP3 (0.52) | NLRP3IL1BTNFKCNH2 |
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 |