Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.40 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.40 |
| ▸ | KCNK3 | O14649 | 3/20 | 0.40 |
| ▸ | KCNK9 | Q9NPC2 | 3/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | TDO2 | P48775 | 2/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | FABP4 | P15090 | 1/20 | 0.39 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL25167821 | 0.80 | ALDH1A1 (0.59) | ALDH1A1KDM4EHPGDHSD17B10AKR1C3 | |
| SCHEMBL23858450 | 0.79 | ALDH1A1 (0.46) | CYP2C19ALDH1A1KDM4EUSP2HPGD | |
| SCHEMBL24269594 | 0.77 | EPHX2 (0.47) | EPHX2CYP2C19KDM4ECYP1A2CYP2C9 | |
| SCHEMBL708079 | 0.77 | PYGL (0.49) | EPHX2CYP2C19ALDH1A1KDM4EUSP2 | |
| SCHEMBL27051473 | 0.77 | ESR1 (0.53) | EPHX2CYP2C19ALDH1A1KDM4EUSP2 | |
| SCHEMBL29940464 | 0.77 | PYGL (0.49) | EPHX2CYP2C19ALDH1A1KDM4EUSP2 | |
| SCHEMBL17339467 | 0.77 | PYGL (0.46) | EPHX2CYP2C19ALDH1A1KDM4EUSP2 | |
| SCHEMBL27628525 | 0.76 | ALDH1A1 (0.39) | CYP2C19ALDH1A1KDM4EUSP2HPGD | |
| SCHEMBL17908047 | 0.76 | KDM4E (0.49) | CYP2C19ALDH1A1KDM4EUSP2HPGD | |
| SCHEMBL3938494 | 0.76 | MAOA (0.48) | CYP2C19ALDH1A1KDM4EUSP2HPGD |
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-2022121844-A1 | DIHYDROPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 上海维申医药有限公司 | 2022-06-16 | — | — | WO | disclosed |