Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 16/20 | 0.62 |
| ▸ | CREBBP | Q92793 | 9/20 | 0.62 |
| ▸ | BRD2 | P25440 | 5/20 | 0.62 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.43 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4712576 | 0.82 | CTSK (0.68) | — | |
| SCHEMBL5888610 | 0.77 | BRD4 (0.74) | BRD4CREBBPBRD2BRD3 | |
| SCHEMBL24726640 | 0.77 | BRD4 (0.78) | BRD4CREBBPBRD2BRD3 | |
| SCHEMBL20546272 | 0.76 | BRD4 (0.61) | BRD4CREBBPBRD2KCNA5HDAC1 | |
| SCHEMBL20546273 | 0.76 | BRD4 (0.61) | BRD4CREBBPBRD2KCNA5HDAC1 | |
| SCHEMBL6218688 | 0.76 | CTSA (0.47) | — | |
| SCHEMBL6215270 | 0.74 | CTSK (0.50) | — | |
| SCHEMBL6215805 | 0.73 | CTSK (0.67) | — | |
| SCHEMBL2852978 | 0.73 | BRD4 (0.76) | BRD4CREBBPBRD2HDAC1BRD3 | |
| SCHEMBL6218748 | 0.73 | CTSK (0.43) | — |
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-2001049288-A9 | NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS | MERCK FROSST CANADA INC (CA) | 2001-10-25 | — | — | WO | claimed |