Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 3/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | TTR | P02766 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1503157 | 1.00 | HTT (0.45) | HTTALDH1A1CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL4524759 | 0.80 | MAPT (0.42) | TTR | |
| SCHEMBL28204423 | 0.80 | TTR (0.34) | HTTALDH1A1TTR | |
| SCHEMBL26568588 | 0.80 | DAO (0.44) | HTTALDH1A1CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL1503218 | 0.80 | PIK3CA (0.45) | HTTALDH1A1DAOMAOBTTR | |
| SCHEMBL31634179 | 0.80 | MAPT (0.42) | TTR | |
| SCHEMBL6744483 | 0.78 | CYP17A1 (0.44) | ALDH1A1CYP17A1CYP11B1CYP11B2TTR | |
| SCHEMBL6744478 | 0.78 | CA1 (0.34) | HTTALDH1A1RIPK1TTR | |
| SCHEMBL15912481 | 0.78 | KDM1A (0.37) | KDM1ATTR | |
| SCHEMBL8951118 | 0.78 | DAO (0.43) | HTTALDH1A1CYP17A1CYP11B1CYP11B2 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113307768-B | Quinolone derivative and preparation method and application thereof | 中国农业科学院兰州畜牧与兽药研究所 | 2023-12-12 | — | — | CN | claimed |
| CN-113307768-B | Quinolone derivative and preparation method and application thereof | 中国农业科学院兰州畜牧与兽药研究所 | 2023-12-12 | — | — | CN | disclosed |
| CN-114516837-B | Nuciferine derivative, and preparation method and application thereof | 山东师范大学 | 2023-11-28 | — | — | CN | disclosed |
| CN-111269221-B | Bicyclic lactams and methods of use thereof | 豪夫迈·罗氏有限公司 | 2023-09-26 | — | — | CN | disclosed |
| CN-114369082-B | Pyridine substituted spiro compounds and application thereof in preparation of anti-plant virus agent | 贵州大学 | 2023-09-05 | — | — | CN | disclosed |
| CN-114516837-A | Nuciferine derivative and preparation method and application thereof | 山东师范大学 | 2022-05-20 | — | — | CN | disclosed |
| CN-114369082-A | Pyridine substituted spiro compound, preparation method thereof and application thereof in preparation of anti-plant virus medicament | 贵州大学 | 2022-04-19 | — | — | CN | disclosed |