Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 13/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 11/20 | 0.54 |
| ▸ | HDAC9 | Q9UKV0 | 10/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 9/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 8/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.54 |
| ▸ | HDAC10 | Q969S8 | 7/20 | 0.54 |
| ▸ | HDAC4 | P56524 | 6/20 | 0.54 |
| ▸ | HDAC7 | Q8WUI4 | 6/20 | 0.54 |
| ▸ | HDAC11 | Q96DB2 | 6/20 | 0.54 |
| ▸ | HDAC5 | Q9UQL6 | 6/20 | 0.54 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13213519 | 0.80 | HDAC1 (0.69) | HDAC1HDAC6HDAC9HDAC2HDAC8 | |
| SCHEMBL8227619 | 0.80 | HDAC1 (0.61) | HDAC1HDAC6HDAC9HDAC2HDAC8 | |
| SCHEMBL8230787 | 0.78 | HDAC1 (0.64) | HDAC1HDAC6HDAC9HDAC2HDAC8 | |
| SCHEMBL8272150 | 0.75 | HDAC1 (0.65) | HDAC1HDAC6HDAC9HDAC2HDAC8 | |
| SCHEMBL8229145 | 0.73 | ALDH1A1 (0.60) | HDAC1HDAC6HDAC9HDAC2HDAC8 | |
| SCHEMBL8229932 | 0.72 | HDAC1 (0.58) | HDAC1HDAC6HDAC9HDAC2HDAC8 | |
| SCHEMBL7930002 | 0.72 | GAA (0.60) | HDAC1HDAC6HDAC9HDAC2HDAC8 | |
| SCHEMBL24359677 | 0.71 | HDAC1 (0.78) | HDAC1HDAC6HDAC9HDAC2HDAC8 | |
| SCHEMBL8227045 | 0.71 | MAPT (0.54) | HDAC1HDAC6HDAC9HDAC2HDAC8 | |
| SCHEMBL7930531 | 0.70 | ABL1 (0.68) | HDAC1HDAC6HDAC9ROCK1ROCK2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006028972-A2 | MERCAPTOAMIDES AS HISTONE DEACETYLASE INHIBITORS | OSI PHARMACEUTICALS, INC. (US) | 2006-03-16 | — | — | WO | disclosed |