Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.37 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | TTBK1 | Q5TCY1 | 4/20 | 0.36 |
| ▸ | TTBK2 | Q6IQ55 | 4/20 | 0.36 |
| ▸ | JAK2 | O60674 | 5/20 | 0.35 |
| ▸ | CLK2 | P49760 | 2/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.30 |
| ▸ | AURKA | O14965 | 1/20 | 0.30 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.30 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.30 |
| ▸ | PAK4 | O96013 | 1/20 | 0.30 |
| ▸ | RET | P07949 | 1/20 | 0.30 |
| ▸ | LTK | P29376 | 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 | |
|---|---|---|---|---|
| SCHEMBL26695951 | 0.78 | DYRK1A (0.34) | ADORA2AADORA1HRH4DYRK1A | |
| SCHEMBL32663536 | 0.78 | DYRK1A (0.34) | ADORA2AADORA1HRH4DYRK1A | |
| SCHEMBL2399491 | 0.73 | AXL (0.33) | — | |
| SCHEMBL9101975 | 0.69 | PRKCI (0.41) | DYRK1AIKBKBCHUKJAK2CLK2 | |
| SCHEMBL27963553 | 0.67 | MAPK1 (0.45) | — | |
| SCHEMBL29540564 | 0.67 | FGFR1 (0.33) | KDR | |
| SCHEMBL16029804 | 0.67 | PRKCI (0.36) | JAK2AURKBJAK1AURKAJAK3 | |
| SCHEMBL28810839 | 0.66 | KDR (0.52) | JAK2CLK2AURKBCLK4MAP4K4 | |
| SCHEMBL9912500 | 0.66 | PIK3CA (0.50) | ADORA2AADORA1HRH4DYRK1AIKBKB | |
| SCHEMBL20657263 | 0.65 | — | — |
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-115244055-B | Pyrimidine five-membered ring derivative and application thereof | 江苏先声药业有限公司 | 2024-09-03 | — | — | CN | disclosed |
| CN-115244055-A | Pyrimido five-membered ring derivative and application thereof | 江苏先声药业有限公司 | 2022-10-25 | — | — | CN | disclosed |