Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 3/20 | 0.58 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | CSNK2A2 | P19784 | 5/20 | 0.50 |
| ▸ | CSNK2B | P67870 | 5/20 | 0.50 |
| ▸ | CSNK2A1 | P68400 | 5/20 | 0.50 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.47 |
| ▸ | PTGES | O14684 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.45 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.45 |
| ▸ | TERT | O14746 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.45 |
| ▸ | TUBB | P07437 | 1/20 | 0.45 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.45 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.45 |
| ▸ | TUBA4A | P68366 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22231469 | 0.87 | CYP1A1 (0.55) | CYP1A1CYP1B1CYP1A2CSNK2A2CSNK2B | |
| SCHEMBL22230934 | 0.84 | CYP1A1 (0.53) | CYP1A1CYP1B1CYP1A2CSNK2A2CSNK2B | |
| SCHEMBL22230886 | 0.84 | CYP1A1 (0.58) | CYP1A1CYP1B1CYP1A2CSNK2A2CSNK2B | |
| SCHEMBL28920731 | 0.81 | CYP1A1 (0.56) | CYP1A1CYP1B1CYP1A2CSNK2A2CSNK2B | |
| SCHEMBL22233089 | 0.80 | CYP1A1 (0.53) | CYP1A1CYP1B1CYP1A2CSNK2A2CSNK2B | |
| SCHEMBL22245254 | 0.79 | CYP1A1 (0.47) | CYP1A1CYP1B1CYP1A2CSNK2A2CSNK2B | |
| SCHEMBL22245264 | 0.79 | CYP1A1 (0.47) | CYP1A1CYP1B1CYP1A2CSNK2A2CSNK2B | |
| SCHEMBL24605428 | 0.78 | CYP1A1 (0.46) | CYP1A1CYP1B1CYP1A2CSNK2A2CSNK2B | |
| SCHEMBL24605429 | 0.78 | CYP1A1 (0.46) | CYP1A1CYP1B1CYP1A2CSNK2A2CSNK2B | |
| SCHEMBL28626708 | 0.78 | CYP1A1 (0.46) | CYP1A1CYP1B1CYP1A2CSNK2A2CSNK2B |
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 |