Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9899911 | 0.88 | GSK3A (0.42) | GSK3AGSK3BCA1CA9 | |
| SCHEMBL10386865 | 0.76 | — | — | |
| SCHEMBL25281993 | 0.68 | GSK3A (0.43) | GSK3AGSK3BCA1CA9 | |
| SCHEMBL17477568 | 0.67 | CA1 (0.44) | GSK3AGSK3BCA1CA9 | |
| SCHEMBL19136070 | 0.67 | CA1 (0.44) | GSK3AGSK3BCA1CA9 | |
| SCHEMBL31425637 | 0.67 | CA1 (0.34) | CA1CA9 | |
| SCHEMBL17526395 | 0.67 | CA1 (0.33) | CA1CA9 | |
| SCHEMBL9527717 | 0.66 | GSK3A (0.46) | GSK3AGSK3B | |
| SCHEMBL943110 | 0.66 | GSK3A (0.46) | GSK3AGSK3B | |
| SCHEMBL25407366 | 0.65 | — | — |
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-109776476-A | A kind of method of -6 (5H) -one of synthesis 5- hydroxyl -3- seleno -4a, 8a- dihydro -2H- chroman | 桂林医学院 | 2019-05-21 | — | — | CN | disclosed |