Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.76 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.76 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.76 |
| ▸ | HPGD | P15428 | 2/20 | 0.76 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.76 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.76 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.76 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.70 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL26679501 | 0.89 | CYP19A1 (0.72) | ALDH1A1ABCG2KDM4EHPGDHSD17B10 | |
| SCHEMBL30000945 | 0.89 | CYP19A1 (0.75) | ALDH1A1ABCG2KDM4EHPGDHSD17B10 | |
| Dimethylpinocembrin SCHEMBL2879027 | 0.86 | ABCG2 (1.00) | ALDH1A1ABCG2KDM4EHPGDHSD17B10 | |
| SCHEMBL28033401 | 0.85 | ABCG2 (0.65) | ALDH1A1ABCG2KDM4EHPGDHSD17B10 | |
| SCHEMBL4826267 | 0.82 | ALDH1A1 (0.83) | ALDH1A1ABCG2KDM4EHPGDHSD17B10 | |
| SCHEMBL18106040 | 0.82 | ALDH1A1 (0.83) | ALDH1A1ABCG2KDM4EHPGDHSD17B10 | |
| SCHEMBL30319723 | 0.82 | ALDH1A1 (0.83) | ALDH1A1ABCG2KDM4EHPGDHSD17B10 | |
| SCHEMBL16894635 | 0.81 | ALDH1A1 (0.63) | ALDH1A1ABCG2KDM4EHPGDHSD17B10 | |
| SCHEMBL5857357 | 0.80 | ALDH1A1 (0.76) | ALDH1A1ABCG2KDM4EHPGDHSD17B10 | |
| SCHEMBL12067056 | 0.80 | ALDH1A1 (0.80) | ALDH1A1ABCG2KDM4EHPGDHSD17B10 |
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-108904491-A | A kind of flavanone compound application in preparation of anti-tumor drugs | 浙江工业大学 | 2018-11-30 | — | — | CN | disclosed |
| CN-108670966-A | Dihydropyran ketone compound application in preparation of anti-tumor drugs | 浙江工业大学 | 2018-10-19 | — | — | CN | disclosed |