Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.49 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 8/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29178133 | 1.00 | EGFR (0.51) | EGFRHSD17B3TLR9ALDH1A1NFE2L2 | |
| SCHEMBL28410988 | 0.90 | NFE2L2 (0.50) | EGFRTLR9ALDH1A1NFE2L2 | |
| SCHEMBL28410987 | 0.90 | NFE2L2 (0.50) | EGFRTLR9ALDH1A1NFE2L2 | |
| SCHEMBL5572462 | 0.82 | TLR9 (0.64) | EGFRTLR9ALDH1A1NFE2L2 | |
| SCHEMBL29149692 | 0.82 | TLR9 (0.64) | EGFRTLR9ALDH1A1NFE2L2 | |
| SCHEMBL5572469 | 0.82 | TLR9 (0.64) | EGFRTLR9ALDH1A1NFE2L2 | |
| SCHEMBL1194075 | 0.81 | TLR9 (0.53) | EGFRTLR9ALDH1A1NFE2L2 | |
| SCHEMBL1194072 | 0.81 | TLR9 (0.53) | EGFRTLR9ALDH1A1NFE2L2 | |
| SCHEMBL7903214 | 0.80 | CYP19A1 (0.59) | EGFRTLR9ALDH1A1NFE2L2MAPT | |
| SCHEMBL7903217 | 0.80 | CYP19A1 (0.59) | EGFRTLR9ALDH1A1NFE2L2MAPT |
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-117430125-A | Preparation method and application of manganese doped mesoporous structure-containing acidic Beta zeolite molecular sieve | 常州大学 | 2024-01-23 | — | — | CN | disclosed |