Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 18/20 | 1.00 |
| ▸ | HDAC2 | Q92769 | 6/20 | 1.00 |
| ▸ | HDAC3 | O15379 | 13/20 | 0.88 |
| ▸ | HDAC1 | Q13547 | 10/20 | 0.72 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28966134 | 0.94 | HDAC6 (1.00) | HDAC6HDAC2HDAC3HDAC1HDAC10 | |
| SCHEMBL30285342 | 0.94 | HDAC6 (1.00) | HDAC6HDAC2HDAC3HDAC1HDAC10 | |
| SCHEMBL28966142 | 0.90 | HDAC6 (1.00) | HDAC6HDAC2HDAC3HDAC1HDAC10 | |
| SCHEMBL28966139 | 0.83 | HDAC6 (1.00) | HDAC6HDAC2HDAC3HDAC1HDAC10 | |
| SCHEMBL28966160 | 0.76 | HDAC6 (1.00) | HDAC6HDAC2HDAC3HDAC1HDAC10 | |
| SCHEMBL2216252 | 0.75 | CYP19A1 (0.70) | HDAC6HDAC2HDAC3 | |
| SCHEMBL27348489 | 0.74 | HDAC6 (0.58) | HDAC6HDAC2HDAC3HDAC1HDAC10 | |
| SCHEMBL27917544 | 0.73 | HDAC2 (0.57) | HDAC6HDAC2HDAC3 | |
| SCHEMBL1003902 | 0.73 | HDAC6 (1.00) | HDAC6HDAC2HDAC3HDAC1HDAC10 | |
| SCHEMBL25382673 | 0.73 | HDAC6 (0.57) | HDAC6HDAC2HDAC3HDAC1HDAC10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115784986-A | HDAC6 inhibitor and preparation method and application thereof | 中国海洋大学 | 2023-03-14 | — | — | CN | claimed |
| CN-115784986-A | HDAC6 inhibitor and preparation method and application thereof | 中国海洋大学 | 2023-03-14 | — | — | CN | disclosed |