Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.49 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.49 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.46 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.46 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | RAD52 | P43351 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11598960 | 0.83 | AKR1B1 (0.54) | ALDH1A1MAPTHPGDHSD17B10CYP1B1 | |
| SCHEMBL124455 | 0.83 | KDM4E (0.61) | ALDH1A1MAPTHPGDHSD17B10CYP1B1 | |
| SCHEMBL2469905 | 0.81 | GRIN2D (0.66) | ALDH1A1MAPTHPGDCASP3GFER | |
| SCHEMBL28989639 | 0.80 | ALDH1A1 (0.49) | ALDH1A1MAPTHPGDCASP3GFER | |
| SCHEMBL15439625 | 0.78 | GRIN2D (0.67) | ALDH1A1MAPTHPGDCASP3GFER | |
| SCHEMBL9625019 | 0.78 | NPC1 (0.58) | ALDH1A1MAPTHPGDCASP3GFER | |
| SCHEMBL10484184 | 0.78 | GRIN2D (0.67) | ALDH1A1MAPTHPGDCASP3GFER | |
| SCHEMBL31742339 | 0.78 | GRIN2D (0.67) | ALDH1A1MAPTHPGDCASP3GFER | |
| SCHEMBL23698264 | 0.77 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDCASP3GFER | |
| SCHEMBL28236960 | 0.76 | CYP1B1 (0.54) | ALDH1A1MAPTHPGDCASP3GFER |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110818630-B | Synthesis method of conjugated (E) -3-cycloalkenyl acrylate derivative | 西南大学 | 2022-06-10 | — | — | CN | claimed |
| CN-110818630-B | Synthesis method of conjugated (E) -3-cycloalkenyl acrylate derivative | 西南大学 | 2022-06-10 | — | — | CN | disclosed |
| CN-110818630-A | Synthesis method of conjugated (E) -3-cycloalkenyl acrylate derivative | 西南大学 | 2020-02-21 | — | — | CN | disclosed |