Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 3/20 | 0.51 |
| ▸ | PDE6D | O43924 | 3/20 | 0.51 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | PDE4A | P27815 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.48 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MC4R | P32245 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.46 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.45 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL31315695 | 0.88 | ALDH1A1 (0.51) | TDP1MAPK1ALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL31315692 | 0.83 | SMN1; SMN2 (0.46) | CFTRMAPK1ALDH1A1MEN1KMT2A | |
| SCHEMBL31315701 | 0.80 | KMT2A (0.47) | TDP1MAPK1ALDH1A1MEN1KMT2A | |
| SCHEMBL31315690 | 0.78 | TP53 (0.46) | ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL29249923 | 0.77 | CFTR (0.56) | CFTRPDE6DPDE4APDE4BPDE4C | |
| SCHEMBL28034992 | 0.77 | CFTR (0.53) | CFTRCNR1CNR2PDE4APDE4B | |
| SCHEMBL29037523 | 0.76 | CFTR (0.62) | CFTRPDE6DPDE4APDE4BPDE4C | |
| SCHEMBL28034968 | 0.74 | CFTR (0.59) | CFTRPDE6DPDE4APDE4BPDE4C | |
| SCHEMBL7897746 | 0.72 | HTR3A (0.53) | PDE6DALDH1A1ALDH2ALDH3A1MEN1 | |
| SCHEMBL6579407 | 0.70 | CFTR (0.63) | CFTRPDE6DPDE4APDE4BPDE4C |
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-115233244-B | Method for electrochemically synthesizing 3-hydroxyalkyl quinoxaline-2 (1H) -ketone compound | 桂林医学院 | 2024-12-27 | — | — | CN | disclosed |