Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | PIK3R1 | P27986 | 3/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 8/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 2/20 | 0.32 |
| ▸ | TYK2 | P29597 | 2/20 | 0.32 |
| ▸ | JAK3 | P52333 | 2/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | PIK3R2 | O00459 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29164574 | 1.00 | CYP1A2 (0.38) | CYP1A2PIK3R1PIK3CAPIK3CDPIK3CG | |
| SCHEMBL29164573 | 1.00 | CYP1A2 (0.38) | CYP1A2PIK3R1PIK3CAPIK3CDPIK3CG | |
| SCHEMBL30822713 | 0.89 | PIK3R1 (0.41) | CYP1A2PIK3R1PIK3CAPIK3CDPIK3CG | |
| SCHEMBL29164722 | 0.89 | PIK3R1 (0.41) | CYP1A2PIK3R1PIK3CAPIK3CDPIK3CG | |
| SCHEMBL29164724 | 0.89 | PIK3R1 (0.41) | CYP1A2PIK3R1PIK3CAPIK3CDPIK3CG | |
| SCHEMBL30822729 | 0.89 | PIK3CD (0.40) | PIK3R1PIK3CAPIK3CDPIK3CGPIK3R2 | |
| SCHEMBL29164738 | 0.89 | PIK3CD (0.37) | PIK3R1PIK3CAPIK3CDPIK3CGMAPK1 | |
| SCHEMBL29164734 | 0.89 | PIK3CD (0.37) | PIK3R1PIK3CAPIK3CDPIK3CGMAPK1 | |
| SCHEMBL29164550 | 0.89 | PIK3CD (0.40) | PIK3R1PIK3CAPIK3CDPIK3CGPIK3R2 | |
| SCHEMBL30822691 | 0.89 | PIK3CD (0.37) | PIK3R1PIK3CAPIK3CDPIK3CGMAPK1 |
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-117659001-A | Aminopyrimidine derivatives and their use in medicine | 广东东阳光药业股份有限公司 | 2024-03-08 | — | — | CN | disclosed |