Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.65 |
| ▸ | HPGD | P15428 | 1/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.65 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | TAS2R31 | P59538 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL28252604 | 0.85 | ALDH1A1 (0.76) | ABCG2ALDH1A1KDM4ECYP3A4HPGD | |
| SCHEMBL26679501 | 0.84 | CYP19A1 (0.72) | ABCG2ALDH1A1KDM4ECYP3A4HPGD | |
| SCHEMBL30000945 | 0.83 | CYP19A1 (0.75) | ABCG2ALDH1A1KDM4ECYP3A4HPGD | |
| SCHEMBL30721031 | 0.82 | NPC1 (0.71) | ABCG2ALDH1A1CYP19A1ADORA3MAPT | |
| SCHEMBL17656774 | 0.81 | ABCG2 (0.76) | ABCG2ALDH1A1KDM4ECYP3A4HPGD | |
| SCHEMBL5085603 | 0.79 | CYP19A1 (0.82) | ABCG2ALDH1A1KDM4ECYP3A4HPGD | |
| Dimethylpinocembrin SCHEMBL2879027 | 0.79 | ABCG2 (1.00) | ABCG2ALDH1A1KDM4ECYP3A4HPGD | |
| SCHEMBL4826267 | 0.77 | ALDH1A1 (0.83) | ABCG2ALDH1A1KDM4ECYP3A4HPGD | |
| SCHEMBL30319723 | 0.77 | ALDH1A1 (0.83) | ABCG2ALDH1A1KDM4ECYP3A4HPGD | |
| SCHEMBL18106040 | 0.77 | ALDH1A1 (0.83) | ABCG2ALDH1A1KDM4ECYP3A4HPGD |
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-105061378-A | Compound for promoting Abelta gathering and preparation method and application thereof | UNIV BEIJING NORMAL | 2015-11-18 | — | — | CN | disclosed |