Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.40 |
| ▸ | UTS2R | Q9UKP6 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29489088 | 1.00 | LMNA (0.41) | LMNAKDM4EALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL31588826 | 0.81 | CYP2D6 (0.45) | LMNAKDM4EALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL2955970 | 0.81 | KDM4E (0.60) | LMNAKDM4EALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL23510565 | 0.80 | KDM4E (0.48) | LMNAKDM4EALDH1A1BTKHTT | |
| SCHEMBL31588506 | 0.80 | NLRP3 (0.50) | LMNAKDM4EALDH1A1BTKHTT | |
| SCHEMBL30553896 | 0.79 | MEN1 (0.54) | LMNAKDM4EALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL28337409 | 0.77 | ALDH1A1 (0.53) | LMNAKDM4EALDH1A1CYP2D6POLB | |
| SCHEMBL29466907 | 0.77 | ALDH1A1 (0.53) | LMNAKDM4EALDH1A1CYP2D6POLB | |
| SCHEMBL31588363 | 0.76 | MAPT (0.43) | LMNAKDM4EALDH1A1CYP3A4MAPK1 | |
| SCHEMBL14313795 | 0.76 | CYP11B1 (0.48) | LMNAKDM4EALDH1A1CYP3A4CYP2D6 |
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-118345388-A | Method for preparing pyrazolone substituted quinoxalinone derivative through electrochemical promotion | 桂林理工大学 | 2024-07-16 | — | — | CN | disclosed |