Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 2/20 | 0.41 |
| ▸ | JAK1 | P23458 | 2/20 | 0.41 |
| ▸ | TYK2 | P29597 | 2/20 | 0.41 |
| ▸ | JAK3 | P52333 | 2/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 4/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | NAE1 | Q13564 | 1/20 | 0.36 |
| ▸ | UBA3 | Q8TBC4 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL3838887 | 1.00 | AURKA (0.43) | AURKARPS6KB1JAK2JAK1TYK2 | |
| SCHEMBL3845859 | 0.88 | AURKA (0.43) | AURKARPS6KB1JAK2JAK1TYK2 | |
| SCHEMBL3840868 | 0.87 | AURKA (0.43) | AURKARPS6KB1JAK2JAK1TYK2 | |
| SCHEMBL3845160 | 0.87 | AURKA (0.43) | AURKARPS6KB1JAK2JAK1TYK2 | |
| SCHEMBL6641894 | 0.87 | AURKA (0.43) | AURKARPS6KB1JAK2JAK1TYK2 | |
| SCHEMBL6644533 | 0.84 | AURKA (0.41) | AURKARPS6KB1JAK2JAK1TYK2 | |
| SCHEMBL6648837 | 0.84 | CRHR1 (0.42) | AURKARPS6KB1 | |
| SCHEMBL3838462 | 0.84 | CRHR1 (0.42) | AURKARPS6KB1 | |
| SCHEMBL3838878 | 0.84 | AURKA (0.41) | AURKARPS6KB1JAK2JAK1TYK2 | |
| SCHEMBL3839117 | 0.80 | AURKA (0.42) | AURKARPS6KB1JAK2JAK1TYK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1446387-B1 | SUBSTITUTED ARYL 1,4-PYRAZINE DERIVATIVES | PHARMACIA & UPJOHN CO LLC (US) | 2009-11-04 | — | — | EP | disclosed |