Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 17/20 | 0.44 |
| ▸ | TTK | P33981 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4291201 | 0.90 | CHEK1 (0.57) | CHEK1TTKAURKBINCENPBCHE | |
| SCHEMBL4302681 | 0.84 | CHEK1 (0.55) | CHEK1 | |
| SCHEMBL4295756 | 0.82 | CHEK1 (0.51) | CHEK1 | |
| SCHEMBL4302677 | 0.82 | CHEK1 (0.54) | CHEK1 | |
| SCHEMBL4289731 | 0.81 | CHEK1 (0.64) | CHEK1 | |
| SCHEMBL4291923 | 0.80 | CHEK1 (0.50) | CHEK1 | |
| SCHEMBL4288965 | 0.80 | CHEK1 (0.50) | CHEK1 | |
| SCHEMBL5015713 | 0.77 | CHEK1 (0.58) | CHEK1PARP1 | |
| SCHEMBL4302910 | 0.77 | CHEK1 (0.52) | CHEK1BCHEACHE | |
| SCHEMBL4294729 | 0.76 | CHEK1 (0.54) | CHEK1PARP1 |
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-1904449-A2 | INHIBITORS OF CHECKPOINT KINASES | Merck & Co., Inc. (US) | 2008-04-02 | — | — | EP | claimed |
| WO-2007008502-A2 | INHIBITORS OF CHECKPOINT KINASES | MERCK & CO., INC. (US) | 2007-01-18 | — | — | WO | claimed |