Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM5 | Q9NZQ8 | 10/20 | 0.42 |
| ▸ | XPO1 | O14980 | 1/20 | 0.41 |
| ▸ | STING1 | Q86WV6 | 2/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | PGK1 | P00558 | 2/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30744202 | 1.00 | TRPM5 (0.42) | TRPM5XPO1STING1TRPA1TRPM4 | |
| SCHEMBL19435570 | 0.79 | XPO1 (0.41) | TRPM5XPO1STING1NPC1GSK3B | |
| SCHEMBL25346900 | 0.79 | AXL (0.47) | XPO1STING1ALDH1A1 | |
| SCHEMBL20338635 | 0.75 | AXL (0.44) | XPO1STING1GSK3BALDH1A1 | |
| SCHEMBL23501432 | 0.72 | CA1 (0.35) | TRPM5TRPA1TRPM4GSK3B | |
| SCHEMBL23501394 | 0.72 | TRPM5 (0.43) | TRPM5TRPA1TRPM4GAANPC1 | |
| SCHEMBL30744214 | 0.72 | TRPM5 (0.43) | TRPM5TRPA1TRPM4GAANPC1 | |
| SCHEMBL30744187 | 0.72 | TRPM5 (0.43) | TRPM5TRPA1TRPM4GSK3B | |
| SCHEMBL23501440 | 0.72 | TRPM5 (0.43) | TRPM5TRPA1TRPM4GSK3B | |
| SCHEMBL38651267 | 0.71 | GAA (0.56) | STING1GAANPC1PGK1GSK3B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112979675-B | Small molecular sulfur-containing heterocyclic compound | 维眸生物科技（上海）有限公司 | 2023-12-19 | — | — | CN | disclosed |
| CN-112979675-A | Small-molecule sulfur-containing heterocyclic compound | 维眸生物科技（上海）有限公司 | 2021-06-18 | — | — | CN | disclosed |
| WO-2021115495-A1 | SMALL-MOLECULE SULFUR-CONTAINING HETEROCYCLIC COMPOUND | 维眸生物科技（上海）有限公司 | 2021-06-17 | — | — | WO | disclosed |