Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | CRHR1 | P34998 | 14/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | GUCY1B2 | O75343 | 1/20 | 0.37 |
| ▸ | GUCY1A2 | P33402 | 1/20 | 0.37 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.37 |
| ▸ | GUCY1B1 | Q02153 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3845876 | 1.00 | AURKA (0.43) | AURKARPS6KB1CRHR1CYP3A4CYP2C9 | |
| SCHEMBL3844530 | 0.88 | CRHR1 (0.43) | AURKARPS6KB1CRHR1 | |
| SCHEMBL3840872 | 0.88 | CRHR1 (0.43) | AURKARPS6KB1CRHR1 | |
| SCHEMBL3840869 | 0.88 | CRHR1 (0.43) | AURKARPS6KB1CRHR1 | |
| SCHEMBL3842059 | 0.87 | AURKA (0.47) | AURKARPS6KB1CRHR1CYP3A4CYP2C9 | |
| SCHEMBL3838878 | 0.85 | AURKA (0.41) | AURKARPS6KB1CRHR1CYP3A4CYP2C9 | |
| SCHEMBL6644533 | 0.85 | AURKA (0.41) | AURKARPS6KB1CRHR1CYP3A4CYP2C9 | |
| SCHEMBL3840868 | 0.81 | AURKA (0.43) | AURKARPS6KB1CRHR1CYP3A4CYP2C9 | |
| SCHEMBL3845160 | 0.81 | AURKA (0.43) | AURKARPS6KB1CRHR1CYP3A4CYP2C9 | |
| SCHEMBL6641894 | 0.81 | AURKA (0.43) | AURKARPS6KB1CRHR1CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1446387-A1 | SUBSTITUTED ARYL 1,4-PYRAZINE DERIVATIVES | PHARMACIA & UPJOHN COMPANY (US) | 2004-08-18 | — | — | EP | disclosed |
| WO-2003045924-A1 | SUBSTITUTED ARYL 1,4-PYRAZINE DERIVATIVES | PHARMACIA & UPJOHN COMPANY (US) | 2003-06-05 | — | — | WO | disclosed |