Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 15/20 | 0.81 |
| ▸ | HDAC1 | Q13547 | 10/20 | 0.81 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.81 |
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 | |
|---|---|---|---|---|
| SCHEMBL16380794 | 0.90 | HDAC2 (1.00) | HDAC2HDAC1HDAC3 | |
| SCHEMBL26775695 | 0.89 | HDAC2 (0.86) | HDAC2HDAC1HDAC3 | |
| SCHEMBL4581182 | 0.87 | HDAC2 (0.83) | HDAC2HDAC1HDAC3 | |
| SCHEMBL15398029 | 0.85 | HDAC1 (0.81) | HDAC2HDAC1HDAC3 | |
| SCHEMBL4322002 | 0.84 | HDAC2 (0.77) | HDAC2HDAC1HDAC3 | |
| SCHEMBL4580508 | 0.84 | HDAC1 (0.77) | HDAC2HDAC1HDAC3 | |
| SCHEMBL15397970 | 0.83 | HDAC2 (0.86) | HDAC2HDAC1HDAC3 | |
| SCHEMBL4311556 | 0.83 | HDAC2 (0.75) | HDAC2HDAC1HDAC3 | |
| SCHEMBL18653511 | 0.83 | HDAC2 (0.75) | HDAC2HDAC1HDAC3 | |
| SCHEMBL2209647 | 0.83 | HDAC2 (0.75) | HDAC2HDAC1HDAC3 |
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-2049124-A2 | PHOSPHORUS DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS | Merck & Co., Inc. (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008010985-A2 | PHOSPHORUS DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS | MERCK & CO., INC. (US) | 2008-01-24 | — | — | WO | disclosed |