Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.50 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | FYN | P06241 | 6/20 | 0.49 |
| ▸ | JAK2 | O60674 | 4/20 | 0.45 |
| ▸ | JAK3 | P52333 | 4/20 | 0.45 |
| ▸ | JAK1 | P23458 | 3/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | ADK | P55263 | 3/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.41 |
| ▸ | PRKDC | P78527 | 3/20 | 0.41 |
| ▸ | ABL1 | P00519 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | HCK | P08631 | 2/20 | 0.41 |
| ▸ | SRC | P12931 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29781042 | 1.00 | ADORA2A (0.50) | ADORA2AADORA2BADORA1ADORA3FYN | |
| SCHEMBL29052107 | 0.85 | JAK2 (0.47) | ADORA2AADORA2BADORA1ADORA3FYN | |
| SCHEMBL29780975 | 0.85 | JAK2 (0.47) | ADORA2AADORA2BADORA1ADORA3FYN | |
| SCHEMBL15826969 | 0.83 | PIK3CD (0.51) | ADORA2AADORA2BADORA1ADORA3JAK2 | |
| SCHEMBL17962785 | 0.82 | FYN (0.49) | ADORA2AADORA2BADORA1ADORA3FYN | |
| SCHEMBL29052149 | 0.80 | ADORA2A (0.49) | ADORA2AADORA2BADORA1ADORA3JAK2 | |
| SCHEMBL29781034 | 0.80 | ADORA2A (0.49) | ADORA2AADORA2BADORA1ADORA3JAK2 | |
| SCHEMBL21851263 | 0.78 | ADORA2A (0.51) | ADORA2AADORA2BADORA1ADORA3JAK2 | |
| SCHEMBL19476278 | 0.77 | ADORA2A (0.49) | ADORA2AADORA2BADORA1ADORA3JAK2 | |
| SCHEMBL29780904 | 0.77 | JAK2 (0.46) | ADORA2AADORA2BADORA1JAK2JAK3 |
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-116583287-A | Pyridazinone heterocyclic compound, preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2023-08-11 | — | — | CN | disclosed |