Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 13/20 | 0.71 |
| ▸ | HDAC1 | Q13547 | 9/20 | 0.71 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.43 |
| ▸ | EPAS1 | Q99814 | 4/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | KLK1 | P06870 | 1/20 | 0.42 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17078973 | 1.00 | HDAC6 (0.71) | HDAC6HDAC1HDAC4KCNH2HIF1A | |
| SCHEMBL17078860 | 0.90 | HDAC6 (0.69) | HDAC6HDAC1HDAC4KCNH2HIF1A | |
| SCHEMBL20432674 | 0.90 | HDAC6 (0.69) | HDAC6HDAC1HDAC4KCNH2HIF1A | |
| SCHEMBL20421100 | 0.89 | HDAC1 (0.55) | HDAC6HDAC1HIF1AEPAS1KLK1 | |
| SCHEMBL17078592 | 0.88 | HDAC1 (0.55) | HDAC6HDAC1HIF1AEPAS1 | |
| SCHEMBL17078539 | 0.88 | HDAC6 (0.55) | HDAC6HDAC1HDAC4KCNH2HDAC8 | |
| SCHEMBL17078955 | 0.88 | HDAC6 (0.69) | HDAC6HDAC1HDAC4KCNH2HIF1A | |
| SCHEMBL17078812 | 0.85 | HDAC6 (0.54) | HDAC6HDAC1HDAC8HDAC3HDAC2 | |
| SCHEMBL20432795 | 0.85 | HDAC6 (0.54) | HDAC6HDAC1HDAC8HDAC3HDAC2 | |
| SCHEMBL17078750 | 0.85 | HDAC6 (0.54) | HDAC6HDAC1HDAC4KCNH2HIF1A |
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 |