Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 11/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 10/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 9/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20629249 | 0.83 | HDAC6 (0.69) | HDAC6HDAC2HDAC8HDAC1HDAC3 | |
| Hydrochloric Acid SCHEMBL20605314 | 0.83 | HDAC6 (0.69) | HDAC6HDAC2HDAC8HDAC1HDAC3 | |
| SCHEMBL20634808 | 0.83 | HDAC6 (0.49) | HDAC6HDAC2HDAC8HDAC1HDAC3 | |
| SCHEMBL20629252 | 0.81 | HDAC6 (0.58) | HDAC6HDAC2HDAC8HDAC1HDAC3 | |
| SCHEMBL20629254 | 0.78 | HDAC6 (0.55) | HDAC6HDAC2HDAC8HDAC1HDAC3 | |
| SCHEMBL20629259 | 0.75 | HDAC6 (0.55) | HDAC6HDAC2HDAC8HDAC1HDAC3 | |
| SCHEMBL20629480 | 0.73 | HDAC6 (0.74) | HDAC6HDAC2HDAC8HDAC1HDAC3 | |
| Hydrochloric Acid SCHEMBL20605429 | 0.73 | HDAC6 (0.75) | HDAC6HDAC2HDAC8HDAC1HDAC3 | |
| SCHEMBL20629461 | 0.70 | HDAC6 (0.63) | HDAC6HDAC2HDAC8HDAC1HDAC3 | |
| SCHEMBL20629465 | 0.66 | HDAC6 (0.69) | HDAC6HDAC2HDAC8HDAC1HDAC3 |
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 |