Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.40 |
| ▸ | CYSLTR1 | Q9Y271 | 3/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21801087 | 0.88 | CYSLTR1 (0.43) | ABCB1BCHECNR2SIGMAR1CYSLTR1 | |
| SCHEMBL21801088 | 0.88 | CYSLTR1 (0.43) | ABCB1BCHECNR2SIGMAR1CYSLTR1 | |
| SCHEMBL26676787 | 0.87 | ABCB1 (0.45) | ABCB1BCHECNR2CYSLTR1ABCG2 | |
| SCHEMBL21801239 | 0.78 | ALDH2 (0.41) | ABCB1SIGMAR1CYSLTR1ABCG2 | |
| SCHEMBL26680673 | 0.78 | SIGMAR1 (0.38) | ABCB1SIGMAR1ABCG2ABCC1 | |
| SCHEMBL21886451 | 0.76 | ABCB1 (0.42) | ABCB1BCHECNR2SIGMAR1CYSLTR1 | |
| SCHEMBL21801083 | 0.76 | CYSLTR1 (0.45) | ABCB1BCHECNR2SIGMAR1CYSLTR1 | |
| SCHEMBL21801081 | 0.76 | CYSLTR1 (0.45) | ABCB1BCHECNR2SIGMAR1CYSLTR1 | |
| SCHEMBL21801191 | 0.76 | CYSLTR1 (0.45) | ABCB1BCHECNR2SIGMAR1CYSLTR1 | |
| SCHEMBL21801052 | 0.75 | CYSLTR1 (0.45) | ABCB1BCHECNR2SIGMAR1CYSLTR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3849966-B1 | FLAVONE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE | HOFFMANN LA ROCHE (CH) | 2023-10-25 | — | — | EP | disclosed |