Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 20/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL4318022 | 0.90 | HDAC1 (0.58) | HDAC1HDAC2HDAC3 | |
| SCHEMBL3643195 | 0.90 | HDAC1 (0.60) | HDAC1HDAC2HDAC3 | |
| SCHEMBL3642454 | 0.90 | HDAC1 (0.58) | HDAC1HDAC2HDAC3 | |
| SCHEMBL1066546 | 0.86 | HDAC1 (0.60) | HDAC1HDAC2HDAC3 | |
| SCHEMBL651437 | 0.86 | HDAC1 (0.67) | HDAC1HDAC2HDAC3 | |
| SCHEMBL2209832 | 0.85 | HDAC1 (0.56) | HDAC1HDAC2HDAC3 | |
| SCHEMBL4506241 | 0.85 | HDAC1 (0.76) | HDAC1HDAC2HDAC3 | |
| SCHEMBL654755 | 0.84 | HDAC1 (0.60) | HDAC1HDAC2HDAC3 | |
| SCHEMBL2686573 | 0.84 | HDAC1 (0.58) | HDAC1HDAC2HDAC3 | |
| SCHEMBL13739084 | 0.84 | HDAC1 (0.57) | HDAC1HDAC2HDAC3 |
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-1991226-A2 | INHIBITORS OF HISTONE DEACETYLASE | Merck & Co., Inc. (US) | 2008-11-19 | — | — | EP | disclosed |
| WO-2007100657-A2 | INHIBITORS OF HISTONE DEACETYLASE | MERCK & CO., INC. (US) | 2007-09-07 | — | — | WO | disclosed |