Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 14/20 | 0.78 |
| ▸ | HDAC6 | Q9UBN7 | 13/20 | 0.78 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.63 |
| ▸ | HDAC4 | P56524 | 6/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.49 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.49 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | TNF | P01375 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL20432669 | 1.00 | HDAC1 (0.78) | HDAC1HDAC6HDAC8HDAC4KCNH2 | |
| SCHEMBL17078677 | 1.00 | HDAC1 (0.78) | HDAC1HDAC6HDAC8HDAC4KCNH2 | |
| SCHEMBL17078922 | 1.00 | HDAC1 (0.78) | HDAC1HDAC6HDAC8HDAC4KCNH2 | |
| SCHEMBL20432860 | 0.99 | HDAC1 (0.77) | HDAC1HDAC6HDAC8HDAC4KCNH2 | |
| SCHEMBL17078939 | 0.99 | HDAC1 (0.77) | HDAC1HDAC6HDAC8HDAC4KCNH2 | |
| SCHEMBL17078956 | 0.94 | HDAC1 (0.78) | HDAC1HDAC6HDAC8HDAC4KCNH2 | |
| SCHEMBL20432905 | 0.93 | HDAC1 (0.72) | HDAC1HDAC6HDAC8HDAC4KCNH2 | |
| SCHEMBL17078844 | 0.93 | HDAC1 (0.72) | HDAC1HDAC6HDAC8HDAC4KCNH2 | |
| SCHEMBL17078724 | 0.92 | HDAC1 (0.71) | HDAC1HDAC6HDAC8HDAC4KCNH2 | |
| SCHEMBL17078489 | 0.92 | HDAC1 (0.76) | HDAC1HDAC6HDAC8HDAC4KCNH2 |
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 |