Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL12160541 | 0.80 | THRB (0.38) | ALDH1A1CA1CA2CA4EPHX1 | |
| SCHEMBL22132057 | 0.79 | ALDH1A1 (0.47) | ALDH1A1CA1CA2CA4 | |
| SCHEMBL21702735 | 0.79 | — | — | |
| SCHEMBL17800115 | 0.79 | ALDH1A1 (0.47) | ALDH1A1CA1CA2CA4 | |
| SCHEMBL4640019 | 0.78 | — | — | |
| SCHEMBL23926891 | 0.76 | — | — | |
| SCHEMBL7251954 | 0.76 | ALDH1A1 (0.64) | ALDH1A1 | |
| SCHEMBL210674 | 0.76 | ALDH1A1 (0.64) | ALDH1A1 | |
| SCHEMBL8797 | 0.76 | — | — | |
| SCHEMBL8070566 | 0.76 | ALDH1A1 (0.64) | ALDH1A1 |
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-112754070-A | Tobacco fragrance solid slow-release cigarette filter stick | 郑州轻工业大学 | 2021-05-07 | — | — | CN | disclosed |