Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 14/20 | 0.66 |
| ▸ | HDAC1 | Q13547 | 10/20 | 0.66 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.50 |
| ▸ | MELK | Q14680 | 1/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.49 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.49 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.49 |
| ▸ | KDM1A | O60341 | 3/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL17078992 | 1.00 | HDAC6 (0.66) | HDAC6HDAC1HDAC4KCNH2HDAC8 | |
| SCHEMBL17078469 | 1.00 | HDAC6 (0.66) | HDAC6HDAC1HDAC4KCNH2HDAC8 | |
| SCHEMBL20432651 | 1.00 | HDAC6 (0.66) | HDAC6HDAC1HDAC4KCNH2HDAC8 | |
| SCHEMBL17079034 | 0.91 | HDAC1 (0.66) | HDAC6HDAC1HDAC4KCNH2HDAC8 | |
| SCHEMBL20432824 | 0.91 | HDAC1 (0.66) | HDAC6HDAC1HDAC4KCNH2HDAC8 | |
| SCHEMBL17078938 | 0.90 | HDAC6 (0.79) | HDAC6HDAC1HDAC4KCNH2HDAC8 | |
| SCHEMBL20432701 | 0.90 | HDAC6 (0.79) | HDAC6HDAC1HDAC4KCNH2HDAC8 | |
| SCHEMBL20432756 | 0.90 | HDAC6 (0.79) | HDAC6HDAC1HDAC4KCNH2HDAC8 | |
| SCHEMBL17078727 | 0.90 | HDAC6 (0.79) | HDAC6HDAC1HDAC4KCNH2HDAC8 | |
| SCHEMBL17079049 | 0.90 | HDAC6 (0.79) | HDAC6HDAC1HDAC4KCNH2HDAC8 |
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 2 patents. 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 |
| US-9278967-B2 | Substituted-quinoxaline-type piperidine compounds and the uses thereof | PURDUE PHARMA L.P. (US) | 2016-03-08 | — | — | US | disclosed |