Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 15/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6507970 | 0.86 | HDAC1 (0.52) | HDAC1CYP3A4NR4A2KDM4EALDH1A1 | |
| SCHEMBL6515011 | 0.80 | HDAC1 (0.52) | HDAC1CYP3A4HDAC3HDAC4HDAC7 | |
| SCHEMBL6513829 | 0.78 | HDAC1 (0.65) | HDAC1CYP3A4HDAC3HDAC4HDAC7 | |
| SCHEMBL6509962 | 0.78 | HDAC1 (0.65) | HDAC1CYP3A4HDAC3HDAC4HDAC7 | |
| SCHEMBL8294397 | 0.75 | HDAC1 (0.54) | HDAC1CYP3A4HDAC3HDAC4HDAC7 | |
| SCHEMBL6509983 | 0.74 | HDAC1 (0.76) | HDAC1CYP3A4HDAC3HDAC4HDAC7 | |
| SCHEMBL6509316 | 0.73 | HDAC1 (0.59) | HDAC1CYP3A4NR4A2KDM4E | |
| SCHEMBL6512133 | 0.73 | HDAC1 (0.61) | HDAC1CYP3A4HDAC3HDAC4HDAC7 | |
| SCHEMBL6508309 | 0.72 | HDAC1 (0.84) | HDAC1CYP3A4 | |
| SCHEMBL6509841 | 0.71 | HDAC1 (0.46) | HDAC1NR4A2KDM4EALDH1A1 |
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-2005014588-A1 | SUBSTITUTED THIENYL-HYDROXAMIC ACIDS HAVING HISTONE DEACETYLASE ACTIVITY | ARGENTA DISCOVERY LIMITED (GB) | 2005-02-17 | — | — | WO | disclosed |