Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 18/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 12/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 11/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.34 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20605229 | 0.85 | HDAC6 (0.56) | HDAC6HDAC8HDAC2HDAC1HDAC4 | |
| SCHEMBL20629554 | 0.75 | HDAC6 (0.54) | HDAC6HDAC8HDAC2HDAC1HDAC4 | |
| SCHEMBL20605239 | 0.74 | HDAC6 (0.70) | HDAC6HDAC8HDAC2HDAC1HDAC4 | |
| SCHEMBL20635512 | 0.74 | HDAC6 (0.53) | HDAC6HDAC8HDAC2HDAC1HDAC4 | |
| SCHEMBL20629558 | 0.74 | HDAC6 (0.58) | HDAC6HDAC8HDAC2HDAC1HDAC4 | |
| SCHEMBL20605315 | 0.74 | HDAC6 (0.62) | HDAC6HDAC8HDAC2HDAC1HDAC4 | |
| SCHEMBL20605285 | 0.73 | HDAC6 (0.77) | HDAC6HDAC8HDAC2HDAC1HDAC4 | |
| SCHEMBL20629250 | 0.73 | HDAC6 (0.57) | HDAC6HDAC8HDAC2HDAC1HDAC4 | |
| SCHEMBL20629287 | 0.73 | HDAC6 (0.56) | HDAC6HDAC8HDAC2HDAC1HDAC10 | |
| SCHEMBL20628948 | 0.70 | HDAC6 (0.55) | HDAC6HDAC8HDAC2HDAC1HDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3424925-A1 | NOVEL HDAC6 INHIBITORS, WITH IMPROVED SOLUBILITY AND THEIR USES | Universität Regensburg (DE) | 2019-01-09 | — | — | EP | disclosed |