Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 20/20 | 0.70 |
| ▸ | HDAC3 | O15379 | 9/20 | 0.70 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.70 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL1640294 | 0.82 | HDAC1 (0.81) | HDAC1HDAC3KCNH2HDAC2 | |
| SCHEMBL1640189 | 0.80 | HDAC1 (1.00) | HDAC1HDAC3KCNH2HDAC2 | |
| SCHEMBL1640910 | 0.77 | KCNH2 (0.76) | HDAC1HDAC3KCNH2HDAC2HDAC4 | |
| SCHEMBL4761565 | 0.76 | HDAC1 (0.53) | HDAC1HDAC3KCNH2HDAC2 | |
| SCHEMBL5548888 | 0.75 | HDAC1 (0.62) | HDAC1HDAC3KCNH2HDAC2HDAC4 | |
| SCHEMBL12963257 | 0.74 | HDAC1 (0.83) | HDAC1HDAC3KCNH2HDAC2HDAC4 | |
| SCHEMBL31109056 | 0.73 | HDAC1 (0.65) | HDAC1HDAC3KCNH2HDAC2HDAC4 | |
| SCHEMBL4577904 | 0.73 | HDAC1 (0.86) | HDAC1HDAC3KCNH2HDAC2HDAC4 | |
| SCHEMBL4580514 | 0.73 | HDAC1 (0.81) | HDAC1HDAC3KCNH2HDAC2HDAC4 | |
| SCHEMBL1068385 | 0.73 | HDAC1 (0.81) | HDAC1HDAC3KCNH2HDAC2HDAC4 |
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-1954698-A1 | SPIROCYCLIC COMPOUNDS AS HDAC INHIBITORS | Merck & Co., Inc. (US) | 2008-08-13 | — | — | EP | claimed |
| WO-2007061880-A1 | SPIROCYCLIC COMPOUNDS AS HDAC INHIBITORS | MERCK & CO., INC. (US) | 2007-05-31 | — | — | WO | claimed |