Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 11/20 | 0.46 |
| ▸ | CDK2AP1 | O14519 | 1/20 | 0.41 |
| ▸ | IKBKB | O14920 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4703834 | 0.97 | CHEK1 (0.47) | CHEK1CDK2AP1IKBKB | |
| SCHEMBL4704847 | 0.89 | CHEK1 (0.56) | CHEK1CDK2AP1IKBKB | |
| SCHEMBL5397223 | 0.87 | CHEK1 (0.59) | CHEK1CDK2AP1 | |
| SCHEMBL4220357 | 0.87 | CHEK1 (0.59) | CHEK1CDK2AP1 | |
| Hydrochloric Acid SCHEMBL4211255 | 0.87 | CHEK1 (0.58) | CHEK1CDK2AP1 | |
| SCHEMBL4704552 | 0.86 | CHEK1 (0.60) | CHEK1CDK2AP1IKBKB | |
| SCHEMBL4209731 | 0.85 | CHEK1 (0.62) | CHEK1CDK2AP1 | |
| Hydrochloric Acid SCHEMBL4213742 | 0.84 | CHEK1 (0.61) | CHEK1CDK2AP1 | |
| SCHEMBL4704773 | 0.83 | CHEK1 (0.53) | CHEK1IKBKB | |
| SCHEMBL4702792 | 0.81 | CHEK1 (0.58) | CHEK1CDK2AP1 |
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-1660474-B1 | SUBSTITUTED THIOPHENES AND USES THEREOF | ASTRAZENECA AB (SE) | 2008-10-29 | — | — | EP | claimed |