Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 18/20 | 0.43 |
| ▸ | ATR | Q13535 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.38 |
| ▸ | TEK | Q02763 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30409444 | 0.88 | HDAC6 (0.41) | HDAC6ATRKDREPHB4TEK | |
| SCHEMBL24216106 | 0.88 | HDAC6 (0.41) | HDAC6ATRKDREPHB4TEK | |
| SCHEMBL30410488 | 0.87 | HDAC6 (0.41) | HDAC6KDREPHB4TEK | |
| SCHEMBL25351699 | 0.86 | HDAC6 (0.53) | HDAC6ATRKDREPHB4TEK | |
| SCHEMBL30408165 | 0.86 | HDAC6 (0.41) | HDAC6 | |
| SCHEMBL24216806 | 0.86 | HDAC6 (0.48) | HDAC6 | |
| SCHEMBL30409505 | 0.86 | HDAC6 (0.48) | HDAC6 | |
| SCHEMBL24215824 | 0.85 | HDAC6 (0.41) | HDAC6KDREPHB4TEK | |
| SCHEMBL30409818 | 0.85 | HDAC6 (0.41) | HDAC6KDREPHB4TEK | |
| SCHEMBL25351503 | 0.84 | RAB9A (0.39) | HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116133658-A | Novel compounds as inhibitors of histone deacetylase 6 and pharmaceutical compositions comprising the same | 株式会社 钟根堂 | 2023-05-16 | — | — | CN | disclosed |