Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IL1B | P01584 | 12/20 | 0.52 |
| ▸ | TNF | P01375 | 3/20 | 0.52 |
| ▸ | NLRP3 | Q96P20 | 9/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL30684741 | 1.00 | IL1B (0.52) | IL1BTNFNLRP3KCNH2TRPV1 | |
| SCHEMBL26092873 | 1.00 | IL1B (0.52) | IL1BTNFNLRP3KCNH2TRPV1 | |
| SCHEMBL27182193 | 1.00 | IL1B (0.52) | IL1BTNFNLRP3KCNH2TRPV1 | |
| Hydrochloric Acid SCHEMBL29975485 | 0.99 | IL1B (0.52) | IL1BTNFNLRP3KCNH2TRPV1 | |
| SCHEMBL29326630 | 0.98 | NLRP3 (0.52) | IL1BTNFNLRP3KCNH2 | |
| SCHEMBL29326452 | 0.94 | NLRP3 (0.52) | IL1BTNFNLRP3KCNH2 | |
| SCHEMBL29326473 | 0.94 | NLRP3 (0.52) | IL1BTNFNLRP3KCNH2 | |
| SCHEMBL24695701 | 0.91 | NLRP3 (0.54) | IL1BTNFNLRP3KCNH2 | |
| SCHEMBL29975632 | 0.90 | NLRP3 (0.55) | IL1BTNFNLRP3KCNH2 | |
| SCHEMBL24696179 | 0.89 | NLRP3 (0.54) | IL1BTNFNLRP3KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116102535-A | Nitrogen-containing compound, preparation method and application thereof | 索智生物科技（浙江）有限公司 | 2023-05-12 | — | — | CN | disclosed |