Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.44 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.44 |
| ▸ | CSNK2A2 | P19784 | 4/20 | 0.43 |
| ▸ | CSNK2B | P67870 | 4/20 | 0.43 |
| ▸ | CSNK2A1 | P68400 | 4/20 | 0.43 |
| ▸ | TERT | O14746 | 4/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28610881 | 0.89 | ALDH1A1 (0.40) | CSNK2A2CSNK2BCSNK2A1CYP1A1CYP1A2 | |
| SCHEMBL22231164 | 0.88 | ABCB1 (0.46) | ABCB1ABCC1ABCG2CSNK2A2CSNK2B | |
| SCHEMBL28610272 | 0.85 | ALDH1A1 (0.39) | CSNK2A2CSNK2BCSNK2A1CYP1A1CYP1A2 | |
| SCHEMBL22232647 | 0.84 | ABCB1 (0.45) | ABCB1ABCC1ABCG2CSNK2A2CSNK2B | |
| SCHEMBL22232646 | 0.83 | ABCB1 (0.44) | ABCB1ABCC1ABCG2CSNK2A2CSNK2B | |
| SCHEMBL22231441 | 0.82 | ABCB1 (0.52) | ABCB1ABCC1ABCG2CSNK2A2CSNK2B | |
| SCHEMBL28610264 | 0.81 | ABCB1 (0.45) | ABCB1ABCC1ABCG2CSNK2A2CSNK2B | |
| SCHEMBL21865983 | 0.80 | CYSLTR1 (0.45) | ABCB1ABCG2SIGMAR1 | |
| SCHEMBL21886426 | 0.80 | CYSLTR1 (0.45) | ABCB1ABCG2SIGMAR1 | |
| SCHEMBL21801143 | 0.80 | CYSLTR1 (0.45) | ABCB1ABCG2SIGMAR1 |
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-113301959-A | Substituted chromen-4-ones for the treatment and prevention of hepatitis B virus infection | 豪夫迈·罗氏有限公司 | 2021-08-24 | — | — | CN | disclosed |