Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 3/20 | 0.38 |
| ▸ | WNT1 | P04628 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL28864606 | 1.00 | PDK1 (0.38) | PDK1WNT1GSK3BDYRK1AKDM1A | |
| SCHEMBL28864590 | 0.82 | ALDH1A1 (0.42) | PDK1ALDH1A1L3MBTL1 | |
| SCHEMBL28864615 | 0.80 | KIT (0.30) | — | |
| SCHEMBL12233169 | 0.79 | PDK1 (0.40) | PDK1WNT1GSK3BDYRK1AKDM1A | |
| SCHEMBL28864624 | 0.78 | PLA2G10 (0.38) | PDK1WNT1GSK3BDYRK1AKDM1A | |
| SCHEMBL28864628 | 0.78 | PLA2G10 (0.38) | PDK1WNT1GSK3BDYRK1AKDM1A | |
| SCHEMBL28864556 | 0.78 | PLA2G10 (0.38) | PDK1WNT1GSK3BDYRK1AKDM1A | |
| Trifluoroacetic Acid SCHEMBL28864610 | 0.78 | HSD17B10 (0.42) | PDK1WNT1GSK3BDYRK1AKDM1A | |
| Trifluoroacetic Acid SCHEMBL28864626 | 0.78 | HSD17B10 (0.42) | PDK1WNT1GSK3BDYRK1AKDM1A | |
| SCHEMBL6284937 | 0.77 | KDM4E (0.47) | ALDH1A1L3MBTL1 |
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-115244047-A | Indazole derivative and application thereof in medicine | 四川海思科制药有限公司 | 2022-10-25 | — | — | CN | disclosed |