Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 18/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.48 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7982194 | 0.81 | NPC1 (0.52) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL10139807 | 0.75 | F9 (0.56) | CHEK2HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL10140086 | 0.74 | PLAU (0.67) | CHEK2 | |
| SCHEMBL7972153 | 0.74 | CHEK2 (0.54) | CHEK2HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL2341761 | 0.73 | HDAC6 (0.77) | CHEK2HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL2649653 | 0.72 | HDAC6 (0.76) | CHEK2HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL18229615 | 0.71 | HDAC6 (1.00) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL20982670 | 0.70 | CHEK2 (0.86) | CHEK2PKN1PKN2 | |
| SCHEMBL6260767 | 0.70 | MMP2 (0.78) | CHEK2HDAC6PKN1PKN2 | |
| SCHEMBL10140770 | 0.70 | CHEK2 (0.51) | CHEK2HDAC3HDAC1HDAC2HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009143039-A2 | HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS | SCHERING CORPORATION (US) | 2009-11-26 | — | — | WO | disclosed |