Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | AR | P10275 | 6/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | BCL2 | P10415 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24976244 | 0.84 | ALDH1A1 (0.53) | ALDH1A1CA1CA2CA9AR | |
| SCHEMBL27968563 | 0.82 | ALDH1A1 (0.54) | ALDH1A1CA1CA2CA9AR | |
| SCHEMBL20194327 | 0.81 | ALDH1A1 (0.53) | ALDH1A1CA1CA2CA9AR | |
| SCHEMBL28446814 | 0.81 | ALDH1A1 (0.61) | ALDH1A1CA1CA2CA9AR | |
| SCHEMBL4970386 | 0.79 | ALDH1A1 (0.50) | ALDH1A1CA1CA2CA9AR | |
| SCHEMBL863475 | 0.78 | ALDH1A1 (0.73) | ALDH1A1CA1CA2CA9ADORA3 | |
| SCHEMBL8861453 | 0.78 | ALDH1A1 (0.62) | ALDH1A1CA1CA2CA9KDM4E | |
| SCHEMBL11545008 | 0.77 | ALDH1A1 (0.61) | ALDH1A1CA1CA2CA9KDM4E | |
| SCHEMBL2334033 | 0.77 | ALDH1A1 (0.61) | ALDH1A1CA1CA2CA9KDM4E | |
| SCHEMBL28052798 | 0.77 | ALDH1A1 (0.61) | ALDH1A1CA1CA2CA9KDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116003391-B | O-hydroxyphenylphthalazinone compound as well as preparation method and application thereof | 四川大学 | 2024-07-09 | — | — | CN | claimed |
| CN-116003391-A | O-hydroxyphenylphthalazinone compound as well as preparation method and application thereof | 四川大学 | 2023-04-25 | — | — | CN | claimed |
| CN-116003391-B | O-hydroxyphenylphthalazinone compound as well as preparation method and application thereof | 四川大学 | 2024-07-09 | — | — | CN | disclosed |
| CN-116003391-A | O-hydroxyphenylphthalazinone compound as well as preparation method and application thereof | 四川大学 | 2023-04-25 | — | — | CN | disclosed |
| CN-113736317-A | Thermosensitive color-changing pen ink | 山东掘色新材料科技有限公司 | 2021-12-03 | — | — | CN | disclosed |