Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 16/20 | 0.46 |
| ▸ | CDK2AP1 | O14519 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1563538 | 0.87 | CHEK1 (0.62) | CHEK1CDK2AP1 | |
| SCHEMBL1563525 | 0.86 | CHEK1 (0.52) | CHEK1CDK2AP1KDM4ENPC1RAB9A | |
| SCHEMBL1562835 | 0.84 | CHEK1 (0.63) | CHEK1CDK2AP1 | |
| SCHEMBL1563866 | 0.82 | CHEK1 (0.43) | CHEK1CDK2AP1KDM4ENPC1RAB9A | |
| SCHEMBL5554677 | 0.82 | CHEK1 (0.55) | CHEK1CDK2AP1 | |
| SCHEMBL1564588 | 0.81 | GAA (0.47) | CHEK1RAB9AALDH1A1HPGD | |
| SCHEMBL5001067 | 0.80 | CHEK1 (0.54) | CHEK1CDK2AP1 | |
| SCHEMBL1562937 | 0.80 | CHEK1 (0.44) | CHEK1CDK2AP1KDM4ENPC1RAB9A | |
| SCHEMBL1770576 | 0.80 | CHEK1 (0.46) | CHEK1CDK2AP1KDM4E | |
| SCHEMBL1562875 | 0.79 | USP30 (0.57) | 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-2305671-A1 | Thiophene and thiazole derivatives as CHK1 inhibitors | AstraZeneca AB (SE) | 2011-04-06 | — | — | EP | disclosed |