Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 11/20 | 0.57 |
| ▸ | PPARG | P37231 | 10/20 | 0.57 |
| ▸ | PPARD | Q03181 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | ACE | P12821 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 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 | |
|---|---|---|---|---|
| SCHEMBL28622647 | 1.00 | PPARA (0.57) | PPARAPPARGPPARDCYP1A2CYP2C9 | |
| SCHEMBL3780424 | 0.85 | ACE (0.48) | PPARAPPARGPPARDIDO1ACE | |
| SCHEMBL28609735 | 0.80 | PPARG (0.41) | PPARAPPARGPPARDCYP1A2CYP2C9 | |
| SCHEMBL23927278 | 0.79 | PPARA (0.64) | PPARAPPARGPPARDCYP1A2CYP2C9 | |
| SCHEMBL1272746 | 0.78 | PPARA (0.65) | PPARAPPARGPPARDCYP1A2CYP2C9 | |
| SCHEMBL2820285 | 0.78 | PPARA (0.65) | PPARAPPARGPPARDCYP1A2CYP2C9 | |
| SCHEMBL3582418 | 0.76 | PPARA (0.90) | PPARAPPARGPPARDACE | |
| SCHEMBL5853138 | 0.76 | PPARA (0.90) | PPARAPPARGPPARDACE | |
| SCHEMBL3362562 | 0.76 | PPARA (0.90) | PPARAPPARGPPARDACE | |
| Hydrochloric Acid SCHEMBL28347112 | 0.75 | PPARA (0.88) | PPARAPPARGPPARDACE |
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 |
|---|---|---|---|---|---|---|---|
| CN-112552211-B | Leonurine derivative and application thereof in preparation of medicines for preventing or treating ischemic cerebrovascular diseases | 青岛海合生物科技有限公司 | 2023-04-14 | — | — | CN | disclosed |
| CN-112552211-A | Leonurine derivative and application thereof in preparation of medicines for preventing or treating ischemic cerebrovascular diseases | 青岛海合生物科技有限公司 | 2021-03-26 | — | — | CN | disclosed |