Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 20/20 | 0.73 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2072997 | 0.95 | HDAC1 (0.67) | HDAC1HDAC3HDAC4HDAC2HDAC6 | |
| SCHEMBL15512816 | 0.91 | HDAC1 (0.67) | HDAC1HDAC3HDAC4HDAC2HDAC6 | |
| SCHEMBL15512600 | 0.89 | HDAC1 (0.63) | HDAC1HDAC3HDAC2HDAC6 | |
| Trifluoroacetic Acid SCHEMBL2071941 | 0.87 | HDAC1 (0.62) | HDAC1HDAC3HDAC4HDAC2HDAC6 | |
| SCHEMBL15513116 | 0.86 | HDAC1 (0.84) | HDAC1HDAC3HDAC4HDAC2HDAC6 | |
| SCHEMBL15512710 | 0.85 | HDAC1 (0.78) | HDAC1HDAC3HDAC4HDAC2HDAC6 | |
| Trifluoroacetic Acid SCHEMBL2074350 | 0.85 | HDAC1 (0.59) | HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL15513774 | 0.85 | HDAC1 (0.82) | HDAC1HDAC3HDAC4HDAC2HDAC6 | |
| SCHEMBL15513024 | 0.84 | HDAC1 (1.00) | HDAC1HDAC3HDAC4HDAC2HDAC6 | |
| SCHEMBL15513186 | 0.84 | HDAC1 (0.80) | HDAC1 |
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 |