Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | KCNK3 | O14649 | 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 | |
|---|---|---|---|---|
| SCHEMBL29138798 | 0.82 | HDAC1 (0.55) | ALDH1A1HTTL3MBTL1ALOX15HDAC1 | |
| SCHEMBL16671050 | 0.81 | NAMPT (0.38) | HTTL3MBTL1KDM4ELMNAROCK2 | |
| SCHEMBL9651972 | 0.77 | KDM4E (0.52) | ALDH1A1HTTL3MBTL1MAPTKDM4E | |
| SCHEMBL29859557 | 0.77 | ALDH1A1 (0.50) | ALDH1A1HTTL3MBTL1ALOX15HDAC1 | |
| SCHEMBL287503 | 0.77 | ALDH1A1 (0.50) | ALDH1A1HTTL3MBTL1ALOX15HDAC1 | |
| SCHEMBL4555559 | 0.75 | L3MBTL1 (0.70) | ALDH1A1HTTL3MBTL1ALOX15HDAC1 | |
| SCHEMBL29504072 | 0.74 | TP53 (0.47) | ALDH1A1HTTL3MBTL1ALOX15HDAC1 | |
| SCHEMBL30173408 | 0.74 | KDM4E (0.41) | ALDH1A1HTTL3MBTL1MAPTKDM4E | |
| SCHEMBL19666628 | 0.73 | TP53 (0.46) | ALDH1A1HTTL3MBTL1ALOX15HDAC1 | |
| SCHEMBL29587357 | 0.72 | ALDH1A1 (0.45) | ALDH1A1HTTL3MBTL1ALOX15HDAC1 |
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-117177963-A | Microbiocidal quinoline/quinoxaline isoquinoline derivatives | 先正达农作物保护股份公司 | 2023-12-05 | — | — | CN | disclosed |