Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB8 | P28062 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KHK | P50053 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24373483 | 0.87 | ALDH1A1 (0.37) | PSMB8ALDH1A1KDM4EPDE10AHSD11B1 | |
| SCHEMBL30774158 | 0.87 | ALDH1A1 (0.37) | PSMB8ALDH1A1KDM4EPDE10AHSD11B1 | |
| SCHEMBL8444755 | 0.73 | MAOA (0.43) | ALDH1A1KDM4EADORA2AADORA1MEN1 | |
| SCHEMBL2123230 | 0.71 | AURKA (0.37) | ALDH1A1KDM4EPDE10AADORA2AADORA1 | |
| SCHEMBL19610576 | 0.71 | MET (0.38) | PSMB8ALDH1A1KDM4EPDE10APTGES | |
| SCHEMBL16390953 | 0.69 | KHK (0.51) | PSMB8ALDH1A1KDM4EADORA2AMEN1 | |
| SCHEMBL8225421 | 0.68 | PARP1 (0.37) | ALDH1A1KDM4EADORA2AADORA1MEN1 | |
| SCHEMBL9794609 | 0.68 | KDM4E (0.39) | PSMB8ALDH1A1KDM4EADORA2AADORA1 | |
| SCHEMBL19889981 | 0.68 | SLC6A3 (0.41) | ALDH1A1KDM4EPARP1 | |
| SCHEMBL30950214 | 0.68 | ENPP1 (0.48) | ALDH1A1KDM4EADORA2AADORA1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023125627-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND APPLICATION THEREOF | LYNK PHARMACEUTICALS CO., LTD. (CN) | 2023-07-06 | — | — | WO | disclosed |