Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 17/20 | 0.80 |
| ▸ | HDAC2 | Q92769 | 15/20 | 0.80 |
| ▸ | HDAC8 | Q9BY41 | 13/20 | 0.80 |
| ▸ | HDAC3 | O15379 | 8/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.53 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.48 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.48 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL20605326 | 0.91 | HDAC6 (0.85) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL22467792 | 0.91 | HDAC6 (0.85) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20635859 | 0.91 | HDAC6 (0.85) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20634170 | 0.90 | HDAC6 (0.82) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20635502 | 0.89 | HDAC6 (1.00) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20629285 | 0.89 | HDAC6 (1.00) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| Hydrochloric Acid SCHEMBL20605225 | 0.89 | HDAC6 (1.00) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20635567 | 0.88 | HDAC6 (0.80) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20634168 | 0.88 | HDAC6 (0.80) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20634791 | 0.88 | HDAC6 (0.80) | HDAC6HDAC2HDAC8HDAC3HDAC1 |
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-2019007836-A1 | NOVEL HDAC6 INHIBITORS, WITH IMPROVED SOLUBILITY AND THEIR USES | UNIVERSITÄT REGENSBURG (DE) | 2019-01-10 | — | — | WO | disclosed |