Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 2/20 | 0.65 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | SLC28A3 | Q9HAS3 | 2/20 | 0.52 |
| ▸ | SLC5A1 | P13866 | 2/20 | 0.51 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL23333492 | 0.84 | TYR (0.72) | TYRNPC1RAB9APOLBSLC5A1 | |
| Arbutin SCHEMBL11191367 | 0.84 | TYR (0.86) | TYRNPC1RAB9APOLBSLC28A3 | |
| SCHEMBL13921313 | 0.84 | TYR (0.57) | TYRNPC1RAB9APOLBSLC5A1 | |
| SCHEMBL23699003 | 0.83 | TYR (0.56) | TYRNPC1RAB9APOLBSLC5A1 | |
| SCHEMBL18732835 | 0.83 | TYR (0.74) | TYRNPC1RAB9APOLBSLC5A1 | |
| SCHEMBL21334201 | 0.83 | TYR (0.74) | TYRNPC1RAB9APOLBSLC5A1 | |
| SCHEMBL21334202 | 0.83 | TYR (0.74) | TYRNPC1RAB9APOLBSLC5A1 | |
| SCHEMBL18718082 | 0.83 | TYR (0.74) | TYRNPC1RAB9APOLBSLC5A1 | |
| SCHEMBL18718085 | 0.83 | TYR (0.74) | TYRNPC1RAB9APOLBSLC5A1 | |
| SCHEMBL18732839 | 0.83 | TYR (0.74) | TYRNPC1RAB9APOLBSLC5A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112851725-B | Gastrodin derivative and preparation method and application thereof | 中国海洋大学 | 2022-12-09 | — | — | CN | disclosed |
| CN-112851725-A | Gastrodin derivative and preparation method and application thereof | 中国海洋大学 | 2021-05-28 | — | — | CN | disclosed |