Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | SLC6A19 | Q695T7 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 3/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.40 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28849828 | 0.82 | ALOX5 (0.44) | MAOBMAOAALDH1A1MEN1KMT2A | |
| SCHEMBL29102005 | 0.81 | GRIK1 (0.43) | MAOBMAOAALDH1A1CYP2D6CYP1B1 | |
| SCHEMBL7112583 | 0.80 | NAAA (0.53) | MAOBALDH1A1CYP2D6MAPT | |
| SCHEMBL2807250 | 0.80 | HSD17B3 (0.45) | HSD17B3PKMSLC6A19BACE1MAOB | |
| SCHEMBL2807247 | 0.80 | HSD17B3 (0.45) | HSD17B3PKMSLC6A19BACE1MAOB | |
| SCHEMBL571592 | 0.78 | HSD17B3 (0.56) | HSD17B3PKMSLC6A19BACE1MAOB | |
| SCHEMBL21791369 | 0.78 | HSD17B3 (0.56) | HSD17B3PKMSLC6A19BACE1MAOB | |
| SCHEMBL571591 | 0.78 | HSD17B3 (0.56) | HSD17B3PKMSLC6A19BACE1MAOB | |
| SCHEMBL933470 | 0.77 | HSD17B3 (0.53) | HSD17B3PKMSLC6A19BACE1MAOB | |
| SCHEMBL28849822 | 0.77 | HSD17B3 (0.54) | HSD17B3PKMSLC6A19BACE1MAOB |
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-114736108-B | Allyl carbonyl enol compound and synthesis method thereof | 同济大学 | 2023-10-27 | — | — | CN | disclosed |