Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29128470 | 0.86 | PPARG (0.38) | PPARGPPARASLC6A4CYP1A2CYP3A4 | |
| SCHEMBL29128369 | 0.80 | PPARG (0.36) | PPARGPPARASLC6A4CYP1A2CYP3A4 | |
| SCHEMBL29125676 | 0.79 | KMT2A (0.34) | PPARGPPARASLC6A4CYP1A2CYP3A4 | |
| SCHEMBL30799861 | 0.79 | DAO (0.39) | SLC6A4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL29128366 | 0.79 | DAO (0.39) | SLC6A4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL29128574 | 0.79 | PPARG (0.33) | PPARGPPARASLC6A4CYP1A2CYP3A4 | |
| SCHEMBL29128169 | 0.78 | ALDH1A1 (0.36) | PPARGPPARASLC6A4CYP1A2CYP3A4 | |
| SCHEMBL29128405 | 0.74 | PPARG (0.38) | PPARGPPARASLC6A4CYP1A2CYP3A4 | |
| SCHEMBL29125832 | 0.72 | KMT2A (0.45) | PPARGPPARASLC6A4CYP1A2CYP3A4 | |
| SCHEMBL29128377 | 0.70 | KDM4E (0.32) | — |
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-117263862-A | Phenol-1, 3-oxazole/dihydroimidazole-2-ketone/thioketone compound and synthesis and application thereof | 吉首大学 | 2023-12-22 | — | — | CN | disclosed |