Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 15/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 14/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.42 |
| ▸ | NCOR2 | Q9Y618 | 3/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17078732 | 1.00 | HDAC6 (0.53) | HDAC6HDAC1HDAC8HDAC10HDAC3 | |
| SCHEMBL17078995 | 0.96 | HDAC1 (0.53) | HDAC6HDAC1HDAC8HDAC10HDAC3 | |
| SCHEMBL20432649 | 0.96 | HDAC1 (0.53) | HDAC6HDAC1HDAC8HDAC10HDAC3 | |
| SCHEMBL20420966 | 0.90 | HDAC1 (0.40) | HDAC6HDAC1HIF1AEPAS1 | |
| SCHEMBL17078650 | 0.89 | MAPK1 (0.41) | HDAC6HDAC1 | |
| SCHEMBL20432874 | 0.87 | HDAC6 (0.58) | HDAC6HDAC1HDAC8HDAC10HDAC3 | |
| SCHEMBL17078871 | 0.87 | HDAC6 (0.58) | HDAC6HDAC1HDAC8HDAC10HDAC3 | |
| SCHEMBL17078673 | 0.86 | MAPK1 (0.43) | HDAC6HDAC1 | |
| SCHEMBL17078619 | 0.85 | HDAC6 (0.46) | HDAC6HDAC1HDAC8HDAC10HDAC3 | |
| SCHEMBL17078752 | 0.83 | HDAC1 (0.52) | HDAC6HDAC1HDAC8HDAC10HDAC3 |
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-3116859-B1 | NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2018-08-01 | — | — | EP | disclosed |