Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGB | P11216 | 5/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | CD69 | Q07108 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MMP12 | P39900 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11518820 | 1.00 | PYGB (0.48) | PYGBCA1CA2CA9ALDH1A1 | |
| SCHEMBL16393089 | 0.87 | CA1 (0.47) | PYGBCA1CA2CA9ALDH1A1 | |
| SCHEMBL11424984 | 0.85 | PYGB (0.65) | PYGBGAA | |
| SCHEMBL11508154 | 0.84 | PYGB (0.68) | PYGBGAA | |
| SCHEMBL11506299 | 0.84 | PYGB (0.68) | PYGBGAA | |
| SCHEMBL11507536 | 0.84 | PYGB (0.68) | PYGBGAA | |
| SCHEMBL9302995 | 0.83 | CA1 (0.60) | PYGBCA1CA2CA9ALDH1A1 | |
| SCHEMBL9302990 | 0.83 | CA1 (0.60) | PYGBCA1CA2CA9ALDH1A1 | |
| SCHEMBL11415353 | 0.80 | LMNA (0.50) | PYGBCA1CA2CA9ALDH1A1 | |
| SCHEMBL11415331 | 0.80 | LMNA (0.50) | PYGBCA1CA2CA9ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4157439-A | ANTITUMOR, LOW TOXICITY, NONHYDROLYZING | SUAMI T (JP) | 1979-06-05 | — | — | US | disclosed |