Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 17/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 15/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL9866534 | 0.83 | GAA (0.46) | HDAC3HDAC1GAAKMT2AHDAC2 | |
| SCHEMBL9335832 | 0.79 | HDAC3 (0.57) | HDAC3HDAC1HDAC2HDAC8HDAC4 | |
| Dodecanoate SCHEMBL7192361 | 0.75 | GAA (0.60) | HDAC3HDAC1GAAKMT2AHDAC2 | |
| SCHEMBL9339460 | 0.74 | NPC1 (0.59) | HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL20339451 | 0.74 | GAA (0.58) | HDAC3HDAC1GAAKMT2AHDAC2 | |
| SCHEMBL29902900 | 0.74 | GAA (0.58) | HDAC3HDAC1GAAKMT2AHDAC2 | |
| SCHEMBL9335577 | 0.74 | CYP2C9 (0.56) | HDAC3HDAC1GAAKMT2AHDAC2 | |
| SCHEMBL5658256 | 0.73 | GAA (0.94) | HDAC3HDAC1GAAKMT2AHDAC2 | |
| SCHEMBL9335939 | 0.73 | HDAC3 (0.39) | HDAC3HDAC1GAA | |
| SCHEMBL1937202 | 0.72 | HDAC3 (1.00) | HDAC3HDAC1HDAC2HDAC8NCOR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0372486-B1 | Benzoic-acid phenylacetic-acid derivatives, their preparation and their use as medicines | HOFFMANN LA ROCHE (CH) | 1994-06-01 | — | — | EP | claimed |