Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL29149576 | 0.90 | PDE4A (0.41) | CYP3A4MAPTACHEHTTL3MBTL1 | |
| SCHEMBL11573349 | 0.90 | TUBB4A (0.42) | CYP3A4MAPTHTTL3MBTL1PDE4D | |
| SCHEMBL12336885 | 0.82 | TPMT (0.41) | CYP3A4MAPTACHEHTTPDE4D | |
| SCHEMBL30730695 | 0.79 | CASP1 (0.44) | CYP3A4ACHEHTTL3MBTL1CA9 | |
| SCHEMBL29941369 | 0.78 | ACHE (0.45) | CYP3A4MAPTACHEHTTL3MBTL1 | |
| SCHEMBL1817023 | 0.76 | ALDH1A1 (0.46) | CYP3A4MAPTPDE4APDE4BPDE4C | |
| SCHEMBL15171993 | 0.74 | HTT (0.35) | MAPTHTTCA9ALDH1A1KDM4E | |
| SCHEMBL29944154 | 0.74 | MAPT (0.52) | CYP3A4MAPTACHEHTTL3MBTL1 | |
| SCHEMBL15172407 | 0.73 | TUBB4A (0.36) | CYP3A4MAPTHTTL3MBTL1PDE4D | |
| SCHEMBL6400299 | 0.73 | CA12 (0.47) | MAPTHTTL3MBTL1CA9PDE4A |
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-117447436-A | Spiropyran derivative, color-changing glass paint and preparation method and application thereof | 广州市科涵实业有限责任公司 | 2024-01-26 | — | — | CN | disclosed |