Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 17/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 14/20 | 0.67 |
| ▸ | HDAC3 | O15379 | 12/20 | 0.67 |
| ▸ | HDAC2 | Q92769 | 12/20 | 0.67 |
| ▸ | HDAC8 | Q9BY41 | 11/20 | 0.67 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.67 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.67 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.67 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.67 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.67 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL15513199 | 0.84 | HDAC1 (0.69) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| SCHEMBL15518637 | 0.83 | HDAC1 (0.69) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| Hydrochloric Acid SCHEMBL2073570 | 0.82 | HDAC1 (0.64) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| Hydrochloric Acid SCHEMBL2072874 | 0.82 | HDAC3 (0.70) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| SCHEMBL15513659 | 0.81 | HDAC6 (0.77) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| SCHEMBL15606564 | 0.80 | HDAC1 (1.00) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| SCHEMBL16968847 | 0.80 | HDAC1 (1.00) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| SCHEMBL15513556 | 0.77 | HDAC1 (0.51) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| Trifluoroacetic Acid SCHEMBL2074522 | 0.77 | HDAC6 (0.71) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| SCHEMBL15512672 | 0.76 | HDAC1 (0.55) | HDAC1HDAC6HDAC3HDAC2HDAC8 |
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-1828171-B1 | HETEROCYCLE DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | ANGELETTI P IST RICHERCHE BIO (IT) | 2014-03-12 | — | — | EP | claimed |