Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 9/20 | 0.47 |
| ▸ | FECH | P22830 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ACP1 | P24666 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2033685 | 0.90 | CHEK1 (0.53) | CHEK1FECHKCNH2KDM4E | |
| SCHEMBL6897387 | 0.83 | HSP90AA1 (0.46) | CHEK1FECHKCNH2KDM4E | |
| SCHEMBL16416700 | 0.82 | CHEK1 (0.49) | CHEK1FECHKCNH2KDM4E | |
| SCHEMBL13997115 | 0.80 | CHEK1 (0.48) | CHEK1FECHKCNH2KDM4E | |
| Hydrochloric Acid SCHEMBL5059305 | 0.80 | CHEK1 (0.47) | CHEK1FECHKCNH2KDM4E | |
| SCHEMBL2037628 | 0.80 | CHEK1 (0.46) | CHEK1FECHKCNH2KDM4E | |
| SCHEMBL5163178 | 0.79 | CHEK1 (0.49) | CHEK1FECHKCNH2 | |
| SCHEMBL5163078 | 0.79 | CHEK1 (0.49) | CHEK1FECHKCNH2 | |
| SCHEMBL5163065 | 0.79 | CHEK1 (0.49) | CHEK1FECHKCNH2 | |
| SCHEMBL2035469 | 0.78 | KDM4E (0.51) | CHEK1FECHKCNH2KDM4E |
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-1379510-A1 | ARYL AND HETEROARYL UREA CHK1 INHIBITORS FOR USE AS RADIOSENSITIZERS AND CHAMOSENSITIZERS | ICOS CORPORATION (US) | 2004-01-14 | — | — | EP | disclosed |
| WO-2002070494-A1 | ARYL AND HETEROARYL UREA CHK1 INHIBITORS FOR USE AS RADIOSENSITIZERS AND CHAMOSENSITIZERS | ICOS CORPORATION (US) | 2002-09-12 | — | — | WO | disclosed |