Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 4/20 | 0.43 |
| ▸ | NFATC1 | O95644 | 3/20 | 0.43 |
| ▸ | GSK3B | P49841 | 3/20 | 0.43 |
| ▸ | KDM5A | P29375 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.38 |
| ▸ | KDM4A | O75164 | 1/20 | 0.38 |
| ▸ | KDM4B | O94953 | 1/20 | 0.38 |
| ▸ | KDM5C | P41229 | 1/20 | 0.38 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.38 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.37 |
| ▸ | PLK1 | P53350 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21676746 | 0.84 | MAOA (0.39) | DYRK1ANFATC1GSK3BKDM5AADORA3 | |
| SCHEMBL23471340 | 0.80 | DYRK1A (0.42) | DYRK1ANFATC1GSK3BKDM5AADORA3 | |
| SCHEMBL13819107 | 0.77 | ADORA3 (0.53) | DYRK1ANFATC1GSK3BKDM5AADORA3 | |
| SCHEMBL16542214 | 0.72 | KDM4C (0.34) | DYRK1ANFATC1GSK3BKDM5AADORA3 | |
| SCHEMBL16542255 | 0.72 | G6PD (0.40) | DYRK1ANFATC1GSK3BKDM5AADORA3 | |
| SCHEMBL22016877 | 0.72 | ADORA3 (0.41) | DYRK1ANFATC1GSK3BKDM5AADORA3 | |
| SCHEMBL1609661 | 0.72 | ADORA3 (0.54) | DYRK1ANFATC1GSK3BADORA3ADORA2A | |
| SCHEMBL22016239 | 0.71 | ADORA3 (0.43) | DYRK1ANFATC1GSK3BKDM5AADORA3 | |
| SCHEMBL15624106 | 0.71 | MAPT (0.40) | DYRK1ANFATC1GSK3BKDM5AADORA3 | |
| SCHEMBL2537047 | 0.70 | ERCC1 (0.52) | FEN1 |
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-2020024997-A1 | PREPARATION AND APPLICATION OF CLASS OF N-CONTAINING HETEROCYCLIC COMPOUNDS HAVING IMMUNOREGULATORY FUNCTION | 上海轶诺药业有限公司 | 2020-02-06 | — | — | WO | disclosed |