Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 20/20 | 0.64 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.64 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL4563369 | 0.93 | HDAC1 (0.64) | HDAC1KCNH2HDAC3HDAC2 | |
| SCHEMBL2209052 | 0.91 | HDAC1 (0.68) | HDAC1KCNH2HDAC3HDAC2 | |
| SCHEMBL2209025 | 0.89 | HDAC1 (0.68) | HDAC1KCNH2HDAC3HDAC2 | |
| SCHEMBL4563371 | 0.87 | HDAC1 (0.64) | HDAC1KCNH2HDAC3HDAC2 | |
| SCHEMBL2209036 | 0.85 | HDAC1 (0.68) | HDAC1KCNH2HDAC3HDAC2 | |
| SCHEMBL4578542 | 0.81 | HDAC1 (0.74) | HDAC1KCNH2HDAC3HDAC2 | |
| SCHEMBL4578426 | 0.81 | HDAC1 (0.76) | HDAC1KCNH2HDAC3HDAC2 | |
| SCHEMBL1063737 | 0.81 | HDAC1 (0.75) | HDAC1KCNH2HDAC3HDAC2 | |
| SCHEMBL4579079 | 0.80 | HDAC1 (0.75) | HDAC1KCNH2HDAC3HDAC2 | |
| SCHEMBL4579199 | 0.80 | HDAC1 (0.72) | HDAC1KCNH2HDAC3HDAC2 |
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 |