Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 13/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 12/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 10/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CHUK | O15111 | 2/20 | 0.40 |
| ▸ | INSR | P06213 | 2/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.40 |
| ▸ | CAMKK2 | Q96RR4 | 2/20 | 0.40 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20629290 | 0.94 | HDAC6 (0.58) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20629485 | 0.92 | HDAC6 (0.69) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| Hydrochloric Acid SCHEMBL20605308 | 0.91 | HDAC6 (0.70) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20629487 | 0.90 | HDAC2 (0.54) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL22487712 | 0.90 | HDAC2 (0.55) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20629287 | 0.87 | HDAC6 (0.56) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20629341 | 0.85 | HDAC6 (0.60) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20629461 | 0.84 | HDAC6 (0.63) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20629289 | 0.83 | HDAC6 (0.48) | HDAC6HDAC2HDAC8HDAC3HDAC1 | |
| SCHEMBL20629480 | 0.82 | HDAC6 (0.74) | 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 |