Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 18/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.53 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.45 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL26969288 | 1.00 | PTGES (0.53) | PTGESPTGS2HCRTR1HCRTR2 | |
| SCHEMBL26969306 | 0.93 | PTGES (0.54) | PTGESPTGS2HCRTR1HCRTR2 | |
| SCHEMBL29551618 | 0.93 | PTGES (0.54) | PTGESPTGS2HCRTR1HCRTR2 | |
| SCHEMBL29550672 | 0.87 | PTGES (0.51) | PTGESPTGS2HCRTR1HCRTR2 | |
| SCHEMBL26969329 | 0.87 | PTGES (0.51) | PTGESPTGS2HCRTR1HCRTR2 | |
| SCHEMBL30464893 | 0.86 | PTGES (0.53) | PTGESPTGS2HCRTR1HCRTR2 | |
| SCHEMBL26969312 | 0.86 | PTGES (0.53) | PTGESPTGS2HCRTR1HCRTR2 | |
| SCHEMBL24462304 | 0.85 | PTGES (0.69) | PTGESPTGS2 | |
| SCHEMBL29630799 | 0.84 | PTGES (0.41) | PTGESPTGS2 | |
| SCHEMBL26225664 | 0.84 | PTGES (0.41) | PTGESPTGS2 |
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-116529246-A | N- [ (1, 3-benzoxazol-2-yl) -heterocycle ] amide derivatives for the treatment and prevention of hepatitis b virus infection | 豪夫迈·罗氏有限公司 | 2023-08-01 | — | — | CN | claimed |