Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.37 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.37 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.37 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.37 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30169697 | 1.00 | ALDH1A1 (0.44) | ALDH1A1CYP3A4HPGDMAPTKDM4E | |
| SCHEMBL25097731 | 1.00 | ALDH1A1 (0.44) | ALDH1A1CYP3A4HPGDMAPTKDM4E | |
| SCHEMBL30169619 | 1.00 | ALDH1A1 (0.44) | ALDH1A1CYP3A4HPGDMAPTKDM4E | |
| SCHEMBL25098017 | 1.00 | ALDH1A1 (0.44) | ALDH1A1CYP3A4HPGDMAPTKDM4E | |
| SCHEMBL25097729 | 0.93 | ALDH1A1 (0.42) | ALDH1A1CYP3A4HPGDMAPTKDM4E | |
| SCHEMBL30169640 | 0.93 | ALDH1A1 (0.42) | ALDH1A1CYP3A4HPGDMAPTKDM4E | |
| SCHEMBL30169707 | 0.89 | ALDH1A1 (0.46) | ALDH1A1CYP3A4HPGDMAPTKDM4E | |
| SCHEMBL21822514 | 0.89 | ALDH1A1 (0.46) | ALDH1A1CYP3A4HPGDMAPTKDM4E | |
| SCHEMBL25097855 | 0.89 | KDM4E (0.41) | ALDH1A1CYP3A4HPGDMAPTKDM4E | |
| SCHEMBL21822488 | 0.89 | KDM4E (0.41) | ALDH1A1CYP3A4HPGDMAPTKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3860984-A1 | FLAVONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE | F. Hoffmann-La Roche AG (CH) | 2021-08-11 | — | — | EP | disclosed |
| WO-2020070088-A1 | FLAVONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE | F. HOFFMANN-LA ROCHE AG (CH) | 2020-04-09 | — | — | WO | disclosed |