Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 16/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 12/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19746368 | 0.85 | HDAC4 (0.56) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL19746486 | 0.83 | HDAC6 (0.44) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL19746714 | 0.83 | HDAC6 (0.44) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL19747128 | 0.82 | HDAC6 (0.46) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL19746657 | 0.82 | HDAC6 (0.47) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL19747203 | 0.81 | HDAC6 (0.47) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL19747204 | 0.81 | HDAC6 (0.47) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL19747032 | 0.78 | HDAC6 (0.48) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL19746213 | 0.75 | HDAC4 (0.46) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL19746855 | 0.74 | HDAC4 (0.52) | HDAC4HDAC6HDAC8HDAC1HDAC5 |
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-2017222952-A1 | 3- HETEROARYL SUBSTITUTED 5-TRIFLUOROMETHYL OXADIAZOLES AS HISTONE DEACETYLASE 6 (HDAC6) INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2017-12-28 | — | — | WO | claimed |