Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 19/20 | 0.72 |
| ▸ | CDK2AP1 | O14519 | 3/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL1563137 | 0.93 | CHEK1 (0.72) | CHEK1CDK2AP1KDM4EMEN1MAPT | |
| SCHEMBL1564828 | 0.90 | CHEK1 (0.73) | CHEK1CDK2AP1KDM4EMEN1MAPT | |
| SCHEMBL1565087 | 0.87 | CHEK1 (0.78) | CHEK1CDK2AP1MAP4K4 | |
| SCHEMBL1563786 | 0.87 | CHEK1 (0.94) | CHEK1CDK2AP1MAP4K4 | |
| SCHEMBL5554681 | 0.85 | CHEK1 (0.76) | CHEK1CDK2AP1MAP4K4 | |
| SCHEMBL1563248 | 0.84 | CHEK1 (1.00) | CHEK1CDK2AP1MAP4K4 | |
| SCHEMBL5550837 | 0.82 | CHEK1 (0.79) | CHEK1CDK2AP1MAP4K4 | |
| SCHEMBL5397223 | 0.80 | CHEK1 (0.59) | CHEK1CDK2AP1 | |
| SCHEMBL4220357 | 0.80 | CHEK1 (0.59) | CHEK1CDK2AP1 | |
| Hydrochloric Acid SCHEMBL4211255 | 0.79 | 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-2305671-A1 | Thiophene and thiazole derivatives as CHK1 inhibitors | AstraZeneca AB (SE) | 2011-04-06 | — | — | EP | disclosed |