Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 19/20 | 0.71 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.67 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.67 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL12434658 | 0.91 | HDAC1 (0.69) | HDAC1HDAC2HDAC3HDAC8 | |
| SCHEMBL2209274 | 0.90 | HDAC1 (0.75) | HDAC1HDAC2HDAC3HDAC8KCNH2 | |
| SCHEMBL4316268 | 0.89 | HDAC1 (0.66) | HDAC1HDAC2HDAC3 | |
| SCHEMBL2210334 | 0.87 | HDAC1 (0.69) | HDAC1HDAC2HDAC3HDAC8KCNH2 | |
| SCHEMBL2209831 | 0.87 | HDAC1 (0.72) | HDAC1HDAC2HDAC3HDAC8KCNH2 | |
| SCHEMBL2206276 | 0.86 | HDAC1 (0.53) | HDAC1HDAC2HDAC3HDAC8KCNH2 | |
| SCHEMBL2211204 | 0.84 | HDAC1 (0.75) | HDAC1HDAC2HDAC3HDAC8KCNH2 | |
| SCHEMBL2212087 | 0.83 | HDAC1 (1.00) | HDAC1HDAC2HDAC3HDAC8 | |
| SCHEMBL8222152 | 0.83 | KCNH2 (0.74) | HDAC1HDAC2HDAC3HDAC8KCNH2 | |
| SCHEMBL2209245 | 0.83 | HDAC1 (1.00) | HDAC1HDAC2HDAC3HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| US-7981874-B2 | Phosphorus derivatives as histone deacetylase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2011-07-19 | — | — | US | claimed |
| US-7981874-B2 | Phosphorus derivatives as histone deacetylase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2011-07-19 | — | — | US | disclosed |