Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.48 |
| ▸ | CHRNA7 | P36544 | 7/20 | 0.47 |
| ▸ | FAAH | O00519 | 2/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL17078797 | 1.00 | HDAC6 (0.48) | HDAC6HDAC1CHRNA7FAAHKCNH2 | |
| SCHEMBL20420953 | 0.91 | FAAH (0.51) | CHRNA7FAAHKCNH2MAOBPOLB | |
| SCHEMBL17078536 | 0.89 | EPHX2 (0.49) | CHRNA7FAAHKCNH2MAOB | |
| SCHEMBL18711183 | 0.80 | HDAC1 (0.50) | HDAC6HDAC1FAAHHDAC8 | |
| SCHEMBL17078474 | 0.80 | HDAC1 (0.59) | HDAC6HDAC1FAAHKCNH2HDAC8 | |
| SCHEMBL20432735 | 0.80 | HDAC1 (0.59) | HDAC6HDAC1FAAHKCNH2HDAC8 | |
| SCHEMBL17079056 | 0.80 | HDAC1 (0.68) | HDAC6HDAC1FAAHHDAC8 | |
| SCHEMBL20432784 | 0.80 | HDAC1 (0.68) | HDAC6HDAC1FAAHHDAC8 | |
| SCHEMBL17078700 | 0.80 | HDAC1 (0.57) | HDAC6HDAC1FAAH | |
| SCHEMBL20432713 | 0.80 | HDAC1 (0.57) | HDAC6HDAC1FAAH |
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 |