Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.56 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.47 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL109280 | 0.93 | CYP3A4 (0.62) | CYP3A4GABRA1GABRB2TRPA1ALDH1A1 | |
| SCHEMBL1669008 | 0.86 | CYP3A4 (0.57) | CYP3A4GABRA1GABRB2TRPA1ALDH1A1 | |
| SCHEMBL28953537 | 0.86 | CYP3A4 (0.57) | CYP3A4GABRA1GABRB2TRPA1ALDH1A1 | |
| SCHEMBL9445659 | 0.83 | CYP3A4 (0.56) | CYP3A4GABRA1GABRB2TRPA1ALDH1A1 | |
| SCHEMBL28831497 | 0.82 | CYP3A4 (0.56) | CYP3A4GABRA1GABRB2TRPA1ALDH1A1 | |
| SCHEMBL28583292 | 0.80 | CYP3A4 (0.87) | CYP3A4GABRA1GABRB2TRPA1ALDH1A1 | |
| SCHEMBL17007517 | 0.80 | CYP3A4 (0.54) | CYP3A4GABRA1GABRB2TRPA1ALDH1A1 | |
| SCHEMBL5456903 | 0.80 | CYP3A4 (0.54) | CYP3A4GABRA1GABRB2TRPA1ALDH1A1 | |
| SCHEMBL462306 | 0.78 | CYP3A4 (0.52) | CYP3A4GABRA1GABRB2TRPA1ALDH1A1 | |
| SCHEMBL30520271 | 0.78 | CYP3A4 (0.63) | CYP3A4GABRA1GABRB2TRPA1ALDH1A1 |
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-109575216-B | Polythiol composition for plastic optical lens | SKC株式会社 | 2021-05-11 | — | — | CN | disclosed |