Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 7/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 7/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6918497 | 0.85 | HDAC6 (0.41) | ROCK2ROCK1HDAC8HDAC1HDAC6 | |
| SCHEMBL6920062 | 0.78 | ALDH1A1 (0.50) | ROCK2ROCK1ALDH1A1HDAC8HDAC1 | |
| SCHEMBL6918441 | 0.78 | ALDH1A1 (0.50) | ROCK2ROCK1ALDH1A1HDAC8HDAC1 | |
| SCHEMBL2407326 | 0.77 | HDAC8 (0.46) | ROCK2ROCK1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6919642 | 0.77 | ALDH1A1 (0.50) | ROCK2ROCK1ALDH1A1HDAC8HDAC1 | |
| SCHEMBL2407257 | 0.76 | HDAC6 (0.47) | ROCK2ROCK1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2407545 | 0.74 | HDAC1 (0.54) | ROCK2ROCK1GAAALDH1A1PKM | |
| SCHEMBL16045284 | 0.73 | CYP1A2 (0.42) | ROCK2ROCK1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL22838539 | 0.71 | SMPD1 (0.53) | HDAC8HDAC1HDAC6SMPD1 | |
| SCHEMBL2407270 | 0.71 | HDAC11 (0.50) | PKMHDAC8HDAC6MEN1KMT2A |
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-2011106632-A1 | SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2011-09-01 | — | — | WO | disclosed |