Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 2/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | IDE | P14735 | 1/20 | 0.38 |
| ▸ | MPI | P34949 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14072437 | 0.80 | ADORA3 (0.68) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL17753301 | 0.79 | ADORA3 (0.61) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL17753303 | 0.79 | ADORA3 (0.61) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL13995844 | 0.79 | ADORA3 (0.61) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL8198639 | 0.79 | ADORA3 (0.61) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL29033598 | 0.76 | ADORA3 (0.62) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL11487364 | 0.76 | ADORA3 (0.58) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL24459228 | 0.76 | KDM4E (0.57) | KDM4EALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL7417909 | 0.75 | ADORA3 (0.57) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL27007503 | 0.73 | KDM4E (0.53) | ADORA3KDM4EALDH1A1HPGDHSD17B10 |
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-117447408-A | N- (2-organic seleno) acrolein quinazolinone and preparation method thereof | 江西师范大学 | 2024-01-26 | — | — | CN | disclosed |