Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 13/20 | 0.70 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.36 |
| ▸ | RORA | P35398 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | RORB | Q92753 | 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 | |
|---|---|---|---|---|
| SCHEMBL6515748 | 0.85 | CHEK1 (0.77) | CHEK1KCNH2AURKAKDRAURKB | |
| SCHEMBL6511411 | 0.85 | CHEK1 (0.80) | CHEK1KCNH2AURKAKDRAURKB | |
| Hydrochloric Acid SCHEMBL6523110 | 0.84 | CHEK1 (0.76) | CHEK1KCNH2AURKAKDRAURKB | |
| SCHEMBL6517703 | 0.83 | CHEK1 (1.00) | CHEK1KCNH2AURKAKDRAURKB | |
| Hydrochloric Acid SCHEMBL6507705 | 0.82 | CHEK1 (0.98) | CHEK1KCNH2AURKAKDRAURKB | |
| SCHEMBL6518149 | 0.82 | CHEK1 (1.00) | CHEK1KCNH2AURKAKDRAURKB | |
| SCHEMBL6513516 | 0.81 | CHEK1 (0.77) | CHEK1KCNH2AURKAKDRAURKB | |
| SCHEMBL6515407 | 0.80 | CHEK1 (0.71) | CHEK1KCNH2AURKAKDRAURKB | |
| SCHEMBL6515081 | 0.79 | CHEK1 (0.74) | CHEK1KCNH2AURKAKDRAURKB | |
| SCHEMBL6511246 | 0.78 | CHEK1 (0.73) | CHEK1KCNH2AURKAKDRAURKB |
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-2005028474-A2 | PYRAZOLOQUINOLINE DERIVATIVES AS CHK-1 INHIBITORS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2005-03-31 | — | — | WO | disclosed |