Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.61 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.61 |
| ▸ | PPARG | P37231 | 1/20 | 0.61 |
| ▸ | PPARD | Q03181 | 1/20 | 0.61 |
| ▸ | PPARA | Q07869 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | MAOB | P27338 | 5/20 | 0.60 |
| ▸ | F3 | P13726 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.58 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.58 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL28679033 | 1.00 | CYP1B1 (0.61) | CYP1B1CYP1A1CYP1A2CYP2D6FFAR1 | |
| SCHEMBL25184991 | 0.89 | MAOB (0.75) | CYP1B1CYP1A1CYP1A2CYP2D6MEN1 | |
| SCHEMBL25217929 | 0.89 | MAOB (0.75) | CYP1B1CYP1A1CYP1A2CYP2D6MEN1 | |
| SCHEMBL25191611 | 0.89 | MAOB (0.75) | CYP1B1CYP1A1CYP1A2CYP2D6MEN1 | |
| SCHEMBL25191809 | 0.89 | MAOB (0.75) | CYP1B1CYP1A1CYP1A2CYP2D6MEN1 | |
| SCHEMBL30383304 | 0.89 | MAOB (0.76) | CYP1B1CYP1A1CYP1A2CYP2D6MEN1 | |
| SCHEMBL11460533 | 0.89 | MAOB (0.76) | CYP1B1CYP1A1CYP1A2CYP2D6MEN1 | |
| SCHEMBL25223392 | 0.89 | MAOB (0.76) | CYP1B1CYP1A1CYP1A2CYP2D6MEN1 | |
| SCHEMBL11451416 | 0.88 | MAOB (0.73) | CYP1B1CYP1A1CYP1A2CYP2D6MEN1 | |
| SCHEMBL11451414 | 0.88 | MAOB (0.73) | CYP1B1CYP1A1CYP1A2CYP2D6MEN1 |
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-107686463-B | Chalcone aryloxy acetamide compound, preparation method and application thereof | 安徽中医药大学 | 2022-02-01 | — | — | CN | disclosed |