Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.38 |
| ▸ | TERT | O14746 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL21801269 | 0.86 | ABCG2 (0.42) | ABCG2ABCB1BCHECNR2MAOB | |
| SCHEMBL21886453 | 0.85 | ABCG2 (0.41) | ABCG2ABCB1BCHECNR2MAOB | |
| SCHEMBL21801243 | 0.84 | ABCG2 (0.41) | ABCG2ABCB1MAOBABCC1SIGMAR1 | |
| SCHEMBL21865634 | 0.79 | ABCB1 (0.43) | ABCG2ABCB1BCHECNR2MAOB | |
| SCHEMBL30744086 | 0.77 | ALDH2 (0.41) | ABCG2ABCB1MAOBABCC1TERT | |
| SCHEMBL21801085 | 0.77 | ALDH2 (0.41) | ABCG2ABCB1MAOBABCC1TERT | |
| SCHEMBL21801231 | 0.76 | MAOB (0.43) | ABCG2ABCB1MAOBTERT | |
| SCHEMBL29180250 | 0.76 | MAOB (0.43) | ABCG2ABCB1MAOBTERT | |
| SCHEMBL21801086 | 0.76 | CYP1A1 (0.60) | ABCG2ABCB1MAOBABCC1 | |
| SCHEMBL21801113 | 0.76 | PPARD (0.39) | ABCG2ABCB1MAOBABCC1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020052774-A1 | FLAVONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE | F. HOFFMANN-LA ROCHE AG (CH) | 2020-03-19 | — | — | WO | disclosed |