Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.57 |
| ▸ | GMNN | O75496 | 1/20 | 0.57 |
| ▸ | APEX1 | P27695 | 1/20 | 0.57 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 8/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.53 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL28766780 | 1.00 | ALDH1A1 (0.57) | ALDH1A1CYP1A2CYP3A4LMNAMAPT | |
| SCHEMBL17302643 | 0.87 | ALDH1A1 (0.57) | ALDH1A1CYP1A2CYP3A4LMNAMAPT | |
| SCHEMBL28766842 | 0.86 | ALDH1A1 (0.56) | ALDH1A1CYP1A2CYP3A4LMNAMAPT | |
| SCHEMBL18579883 | 0.85 | ALDH1A1 (0.55) | ALDH1A1CYP1A2CYP3A4LMNAMAPT | |
| SCHEMBL18580643 | 0.84 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP3A4LMNAMAPT | |
| SCHEMBL30909351 | 0.83 | HTT (0.61) | ALDH1A1CYP1A2CYP3A4LMNAMAPT | |
| SCHEMBL8508099 | 0.83 | HTT (0.66) | ALDH1A1CYP1A2CYP3A4LMNAMAPT | |
| SCHEMBL6238201 | 0.83 | HTT (0.61) | ALDH1A1CYP1A2CYP3A4LMNAMAPT | |
| SCHEMBL8299472 | 0.83 | ALDH1A1 (0.53) | ALDH1A1CYP1A2CYP3A4LMNAMAPT | |
| SCHEMBL18413029 | 0.83 | ALDH1A1 (0.55) | ALDH1A1CYP1A2CYP3A4LMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114516844-B | Quinoxaline derivative, preparation method and application | 贵州大学 | 2024-07-19 | — | — | CN | disclosed |
| CN-114516844-A | Quinoxaline derivative, preparation method and application | 贵州大学 | 2022-05-20 | — | — | CN | disclosed |