Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 4/20 | 0.41 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | LPL | P06858 | 1/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | PLAU | P00749 | 2/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL21914667 | 1.00 | ALDH1A1 (0.43) | ALDH1A1CYP3A4HPGDHSD17B10CNR1 | |
| SCHEMBL14316663 | 0.93 | ALDH1A1 (0.42) | ALDH1A1CYP3A4HPGDHSD17B10PDK2 | |
| SCHEMBL21913917 | 0.92 | ALDH1A1 (0.43) | ALDH1A1CYP3A4HPGDHSD17B10CNR1 | |
| SCHEMBL16017144 | 0.92 | ALDH1A1 (0.45) | ALDH1A1CYP3A4HPGDHSD17B10PDK2 | |
| SCHEMBL29829158 | 0.92 | ALDH1A1 (0.45) | ALDH1A1CYP3A4HPGDHSD17B10PDK2 | |
| SCHEMBL31504664 | 0.92 | ALDH1A1 (0.45) | ALDH1A1CYP3A4HPGDHSD17B10PDK2 | |
| SCHEMBL20935760 | 0.91 | PDK2 (0.46) | ALDH1A1CNR1PDK2MAPTMEN1 | |
| SCHEMBL16017108 | 0.90 | PDK2 (0.43) | ALDH1A1CYP3A4HPGDHSD17B10PDK2 | |
| SCHEMBL10034427 | 0.89 | ALDH1A1 (0.46) | ALDH1A1CYP3A4HPGDHSD17B10CNR1 | |
| SCHEMBL21386483 | 0.88 | ALDH1A1 (0.54) | ALDH1A1CYP3A4HPGDHSD17B10CNR1 |
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-118488943-A | Compound and organic light emitting device comprising the same | 株式会社LG化学 | 2024-08-13 | — | — | CN | disclosed |