Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | CSNK2A2 | P19784 | 6/20 | 0.41 |
| ▸ | CSNK2B | P67870 | 6/20 | 0.41 |
| ▸ | CSNK2A1 | P68400 | 6/20 | 0.41 |
| ▸ | F9 | P00740 | 1/20 | 0.40 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 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 | |
|---|---|---|---|---|
| SCHEMBL22245055 | 0.92 | CSNK2A2 (0.43) | KDM4EALDH1A1CYP1A2HPGDCSNK2A2 | |
| SCHEMBL22231391 | 0.89 | CSNK2A2 (0.41) | ALDH1A1CYP1A2POLBCYP3A4CYP2C19 | |
| SCHEMBL22244889 | 0.88 | KDM4E (0.49) | KDM4EALDH1A1CYP1A2POLBCYP3A4 | |
| SCHEMBL22230875 | 0.82 | CSNK2A2 (0.53) | KDM4EALDH1A1CYP1A2POLBCYP3A4 | |
| SCHEMBL22230934 | 0.81 | CYP1A1 (0.53) | KDM4EALDH1A1CYP1A2POLBCYP3A4 | |
| SCHEMBL28623674 | 0.81 | CSNK2A2 (0.43) | KDM4EALDH1A1CYP1A2POLBCYP3A4 | |
| SCHEMBL22231502 | 0.79 | TERT (0.50) | KDM4EALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL22230847 | 0.78 | CSNK2A2 (0.46) | KDM4EALDH1A1HPGDCSNK2A2CSNK2B | |
| SCHEMBL22231935 | 0.77 | CSNK2A2 (0.38) | ALDH1A1CYP1A2CYP3A4CYP2C9HPGD | |
| SCHEMBL22231472 | 0.76 | CSNK2A2 (0.39) | CYP1A2CSNK2A2CSNK2BCSNK2A1ABCC1 |
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 |