Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.46 |
| ▸ | CA12 | O43570 | 4/20 | 0.44 |
| ▸ | CA9 | Q16790 | 4/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | BACE1 | P56817 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL38650628 | 1.00 | ACHE (0.46) | ACHECA12CA9CA1CA2 | |
| SCHEMBL31053942 | 0.85 | ACHE (0.42) | ACHECA12CA9CA1CA2 | |
| SCHEMBL30712746 | 0.82 | ACHE (0.46) | ACHECA9CA1CA2BACE1 | |
| SCHEMBL30153685 | 0.81 | TYR (0.45) | CA12CA9CA1CA2GAA | |
| SCHEMBL31711467 | 0.72 | NR3C1 (0.32) | ALDH1A1KMT2A | |
| SCHEMBL31229542 | 0.72 | TYR (0.44) | GAAALDH1A1 | |
| SCHEMBL20315376 | 0.66 | GAA (0.65) | ACHECA12CA9CA1CA2 | |
| SCHEMBL8325931 | 0.66 | GAA (0.65) | ACHECA12CA9CA1CA2 | |
| SCHEMBL5793535 | 0.66 | GAA (0.65) | ACHECA12CA9CA1CA2 | |
| SCHEMBL7687892 | 0.66 | GAA (0.59) | ACHECA2GAACDK1CCNB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117405791-B | Construction method and quality detection method of fingerprint of lung-heat-clearing decoction compound preparation | 江西药都樟树制药有限公司 | 2025-04-18 | — | — | CN | disclosed |
| CN-117405791-A | Construction method and quality detection method of fingerprint of lung-heat-clearing decoction compound preparation | 江西药都樟树制药有限公司 | 2024-01-16 | — | — | CN | disclosed |