Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | JUN | P05412 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.30 |
| ▸ | RELA | Q04206 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25324096 | 1.00 | TRPA1 (0.33) | TRPA1JUNNFKB1NFKB2RELA | |
| SCHEMBL25322547 | 0.72 | TRPA1 (0.40) | TRPA1 | |
| SCHEMBL31532337 | 0.70 | — | — | |
| SCHEMBL31026268 | 0.68 | — | — | |
| SCHEMBL25297918 | 0.68 | ALDH1A1 (0.34) | — | |
| SCHEMBL30395366 | 0.68 | ALDH1A1 (0.34) | — | |
| SCHEMBL25412193 | 0.68 | CYP3A4 (0.38) | — | |
| SCHEMBL27357711 | 0.67 | KCNJ6 (0.35) | — | |
| SCHEMBL31365776 | 0.67 | GABRA1 (0.32) | — | |
| SCHEMBL27172746 | 0.67 | SIRT6 (0.34) | TRPA1 |
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-119654326-A | Novel heterocyclic compounds | 豪夫迈·罗氏有限公司 | 2025-03-18 | — | — | CN | disclosed |