Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TERT | O14746 | 7/20 | 0.77 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.72 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.72 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.72 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.72 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.69 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.69 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | MAPT | P10636 | 3/20 | 0.67 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.67 |
| ▸ | HPGD | P15428 | 2/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.67 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.66 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.66 |
| ▸ | USP2 | O75604 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL988001 | 1.00 | TERT (0.77) | TERTCYP3A4CYP1A2CYP2C19NCOA1 | |
| SCHEMBL6613755 | 0.88 | TERT (0.77) | TERTCYP3A4CYP1A2CYP2C19NCOA1 | |
| SCHEMBL16894651 | 0.88 | TUBB4A (0.76) | TERTCYP3A4CYP1A2CYP2C19NCOA1 | |
| SCHEMBL6612282 | 0.88 | TUBB4A (0.76) | TERTCYP3A4CYP1A2CYP2C19NCOA1 | |
| SCHEMBL6803148 | 0.87 | TERT (0.80) | TERTCYP3A4CYP1A2CYP2C19NCOA1 | |
| SCHEMBL6614329 | 0.87 | TERT (1.00) | TERTCYP3A4CYP1A2CYP2C19NCOA1 | |
| SCHEMBL27381836 | 0.86 | CYP1A2 (0.73) | TERTCYP3A4CYP1A2CYP2C19NCOA1 | |
| SCHEMBL16704751 | 0.86 | CYP1A1 (0.76) | TERTCYP3A4CYP1A2CYP2C19NCOA1 | |
| SCHEMBL21647169 | 0.86 | CYP1A2 (0.73) | TERTCYP3A4CYP1A2CYP2C19NCOA1 | |
| SCHEMBL4649487 | 0.86 | CYP3A4 (0.76) | TERTCYP3A4CYP1A2CYP2C19NCOA1 |
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-110498784-B | Nobiletin derivatives or pharmaceutically acceptable salts thereof, and preparation method and application thereof | 广东克冠达医药科技有限公司 | 2022-06-14 | — | — | CN | disclosed |