Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 14/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 10/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 9/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3439440 | 0.84 | MEN1 (0.46) | MGLLHDAC1HDAC8HDAC6HDAC2 | |
| SCHEMBL8324956 | 0.80 | HDAC1 (0.54) | HDAC1HDAC8HDAC6HDAC2HDAC11 | |
| SCHEMBL8318572 | 0.78 | HDAC1 (0.50) | HDAC1HDAC8HDAC6HDAC2HDAC11 | |
| SCHEMBL8319569 | 0.78 | TGFBR1 (0.44) | TGFBR1HDAC1HDAC8HDAC6HDAC2 | |
| SCHEMBL4258906 | 0.77 | MGLL (0.46) | MGLLHDAC1HDAC8HDAC6HDAC2 | |
| SCHEMBL4258903 | 0.77 | MGLL (0.46) | MGLLHDAC1HDAC8HDAC6HDAC2 | |
| SCHEMBL8323972 | 0.77 | BRD4 (0.43) | HDAC1HDAC8HDAC6HDAC2HDAC11 | |
| SCHEMBL15341321 | 0.77 | TRPV1 (0.46) | TGFBR1MGLLHDAC1HDAC8HDAC6 | |
| SCHEMBL8319464 | 0.76 | SMN1; SMN2 (0.46) | HDAC1HDAC8HDAC6HDAC2HDAC11 | |
| SCHEMBL30711913 | 0.76 | EPHX2 (0.46) | TGFBR1MGLLHDAC1HDAC8HDAC6 |
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-2004063169-A1 | HYDROXAMID ACID DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | ASTELLAS PHARMA INC. (JP) | 2004-07-29 | — | — | WO | disclosed |