Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 19/20 | 0.61 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.60 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL18745926 | 0.86 | CHEK2 (0.47) | CHEK2PKN1PKN2 | |
| SCHEMBL31721327 | 0.84 | TDP1 (0.68) | CHEK2 | |
| SCHEMBL12685844 | 0.83 | ABL1 (0.68) | CHEK2PKN1PKN2 | |
| SCHEMBL9304016 | 0.81 | CHEK2 (0.63) | CHEK2PKN1PKN2 | |
| SCHEMBL7868231 | 0.81 | CHEK2 (0.60) | CHEK2PKN1PKN2 | |
| SCHEMBL7428472 | 0.81 | HSP90AA1 (0.73) | CHEK2PKN1PKN2 | |
| SCHEMBL20982670 | 0.80 | CHEK2 (0.86) | CHEK2PKN1PKN2 | |
| SCHEMBL10468392 | 0.80 | HSP90AA1 (0.46) | CHEK2PKN1PKN2 | |
| SCHEMBL7984805 | 0.79 | ALDH1A1 (0.46) | CHEK2 | |
| SCHEMBL20683048 | 0.78 | CHEK2 (0.57) | CHEK2PKN1PKN2 |
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-2265590-A2 | SELECTIVE INHIBITORS OF HISTONE DEACETYLASE | PHARMACYCLICS, INC. (US) | 2010-12-29 | — | — | EP | disclosed |
| WO-2009129335-A2 | SELECTIVE INHIBITORS OF HISTONE DEACETYLASE | PHARMACYCLICS, INC. (US) | 2009-10-22 | — | — | WO | disclosed |