Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.63 |
| ▸ | PPARA | Q07869 | 1/20 | 0.63 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.54 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.49 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6494445 | 0.89 | CYP4F2 (0.54) | PPARGPPARACYP4F2CYP4A11ALOX5 | |
| SCHEMBL491276 | 0.85 | CYP4F2 (0.59) | CYP4F2CYP4A11KMT2AMEN1LMNA | |
| SCHEMBL8912630 | 0.84 | CYP4F2 (0.58) | CYP4F2CYP4A11ALOX5OR51E2ALDH1A1 | |
| Dihydroferulic Acid Ethyl Ester SCHEMBL356300 | 0.83 | ALOX5 (0.67) | CYP4F2CYP4A11ALOX5OR51E2ALDH1A1 | |
| SCHEMBL7520208 | 0.83 | CYP4F2 (0.56) | PPARGPPARACYP4F2CYP4A11APP | |
| SCHEMBL2290474 | 0.82 | PPARG (0.58) | PPARGPPARAALOX5OR51E2ALDH1A1 | |
| SCHEMBL3963370 | 0.82 | PPARA (0.78) | PPARGPPARAALOX5OR51E2ALDH1A1 | |
| SCHEMBL4167602 | 0.82 | CYP4F2 (0.55) | CYP4F2CYP4A11ALOX5OR51E2ALDH1A1 | |
| SCHEMBL17295176 | 0.82 | CYP4F2 (0.55) | CYP4F2CYP4A11ALOX5OR51E2ALDH1A1 | |
| SCHEMBL3142149 | 0.82 | CYP4F2 (0.55) | CYP4F2CYP4A11ALOX5OR51E2ALDH1A1 |
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-113582911-B | Multi-target donepezil-hydroxamic acid compound, and preparation method and application thereof | 山东大学 | 2024-03-12 | — | — | CN | disclosed |
| CN-113582911-A | Multi-target donepezil-hydroxamic acid type compound and preparation method and application thereof | 山东大学 | 2021-11-02 | — | — | CN | disclosed |