Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.31 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3230242 | 0.79 | HDAC1 (0.43) | HDAC3HDAC1PDCD1CD274ACHE | |
| SCHEMBL3241826 | 0.71 | HDAC1 (0.36) | HDAC3HDAC1ACHE | |
| SCHEMBL3262238 | 0.71 | HDAC3 (0.35) | HDAC3HDAC1ACHE | |
| SCHEMBL25173042 | 0.64 | PTGER1 (0.39) | HDAC3HDAC1 | |
| SCHEMBL25264153 | 0.64 | PTGER4 (0.39) | — | |
| SCHEMBL3234068 | 0.61 | ACHE (0.46) | HDAC3HDAC1ACHE | |
| SCHEMBL1064934 | 0.60 | HDAC3 (0.42) | HDAC3HDAC1ACHE | |
| SCHEMBL7932753 | 0.59 | HDAC3 (0.47) | HDAC3HDAC1 | |
| SCHEMBL27819079 | 0.59 | GPR3 (0.43) | HDAC3 | |
| SCHEMBL5840878 | 0.59 | KMT2A (0.47) | HDAC3HDAC1 |
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-2010028193-A1 | COMPOUNDS INCLUDING PIMELIC ACID DERIVATIVES AS HDAC INHIBITORS | REPLIGEN CORPORATION (US) | 2010-03-11 | — | — | WO | disclosed |