Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21185009 | 0.81 | HDAC9 (0.31) | ALDH1A1MAPTHPGDALOX12TDP1 | |
| SCHEMBL19939944 | 0.80 | RYR2 (0.32) | ALDH1A1HPGDTDP1 | |
| SCHEMBL20015049 | 0.78 | RYR2 (0.30) | — | |
| SCHEMBL20015243 | 0.77 | DRD2 (0.34) | ALDH1A1HPGDTDP1TP53 | |
| SCHEMBL24831713 | 0.75 | MEN1 (0.33) | ALDH1A1MAPTHPGDALOX12TDP1 | |
| SCHEMBL21185263 | 0.72 | ALDH1A1 (0.35) | ALDH1A1MAPTHPGDALOX12TDP1 | |
| SCHEMBL20014517 | 0.70 | MEN1 (0.43) | ALDH1A1MAPTHPGDALOX12TDP1 | |
| SCHEMBL20123665 | 0.70 | RYR2 (0.34) | ALDH1A1HPGDTDP1 | |
| SCHEMBL22813506 | 0.69 | — | — | |
| SCHEMBL19940394 | 0.69 | ALDH1A1 (0.32) | ALDH1A1MAPTHPGDALOX12TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019141179-A1 | PYRIDONE DERIVATIVE, COMPOSITION THEREOF AND APPLICATION THEREOF AS ANTI-INFLUENZA DRUG | 银杏树药业(苏州)有限公司 | 2019-07-25 | — | — | WO | disclosed |