Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 19/20 | 0.71 |
| ▸ | TYK2 | P29597 | 19/20 | 0.71 |
| ▸ | JAK2 | O60674 | 15/20 | 0.55 |
| ▸ | JAK3 | P52333 | 13/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29520351 | 1.00 | JAK1 (0.71) | JAK1TYK2JAK2JAK3MEN1 | |
| SCHEMBL28663088 | 0.87 | JAK1 (0.73) | JAK1TYK2JAK2JAK3 | |
| SCHEMBL29520567 | 0.87 | JAK1 (0.73) | JAK1TYK2JAK2JAK3 | |
| SCHEMBL28664034 | 0.86 | JAK1 (0.67) | JAK1TYK2JAK2JAK3 | |
| SCHEMBL28666764 | 0.83 | JAK1 (0.70) | JAK1TYK2JAK2JAK3 | |
| SCHEMBL28657664 | 0.82 | JAK1 (0.70) | JAK1TYK2JAK2JAK3 | |
| SCHEMBL28654828 | 0.73 | JAK1 (0.84) | JAK1TYK2JAK2JAK3 | |
| SCHEMBL28674913 | 0.72 | JAK1 (0.81) | JAK1TYK2JAK2JAK3 | |
| SCHEMBL28659639 | 0.71 | JAK1 (1.00) | JAK1TYK2JAK2JAK3 | |
| SCHEMBL28928773 | 0.70 | TYK2 (1.00) | JAK1TYK2JAK2JAK3 |
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-113461687-B | 2, 8-aza- [4,5] decaspirocyclic ketone derivative and preparation method and application thereof | 四川大学华西医院 | 2022-04-19 | — | — | CN | disclosed |
| CN-113461687-A | 2, 8-aza- [4,5] decaspirocyclic ketone derivative and preparation method and application thereof | 四川大学华西医院 | 2021-10-01 | — | — | CN | disclosed |