Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.36 |
| ▸ | HPGD | P15428 | 5/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | CASP1 | P29466 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28538297 | 0.81 | CES1 (0.38) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL3783406 | 0.80 | ALDH1A1 (0.46) | ALDH1A1HSD17B10HPGDHIF1ATSHR | |
| SCHEMBL28376300 | 0.79 | ALDH1A1 (0.55) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL14718717 | 0.78 | ALDH1A1 (0.47) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL17136293 | 0.78 | ALDH1A1 (0.36) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL5965314 | 0.78 | CYP1A2 (0.41) | ALDH1A1HSD17B10HPGDHIF1ATSHR | |
| SCHEMBL1168422 | 0.78 | ALDH1A1 (0.50) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL14322661 | 0.77 | ALDH1A1 (0.48) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL2871930 | 0.76 | ALDH1A1 (0.50) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL29354014 | 0.76 | ALDH1A1 (0.50) | ALDH1A1KDM4EGAAHSD17B10HPGD |
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-117304131-A | Alpha-carbonyl alkenyl ester compound, and preparation method and application thereof | 广州医科大学 | 2023-12-29 | — | — | CN | disclosed |