Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 8/20 | 0.65 |
| ▸ | VCP | P55072 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.40 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30518168 | 0.81 | HDAC1 (0.60) | HDAC1CYP3A4HDAC3NCOR1HDAC2 | |
| SCHEMBL210054 | 0.79 | HDAC1 (1.00) | HDAC1CYP3A4HDAC3NCOR1HDAC2 | |
| SCHEMBL213325 | 0.77 | HDAC1 (0.71) | HDAC1VCPMKNK1MKNK2PTGDR | |
| SCHEMBL18808254 | 0.76 | HDAC1 (0.72) | HDAC1VCPCYP3A4HDAC3NCOR1 | |
| SCHEMBL5733996 | 0.71 | HDAC1 (0.48) | HDAC1MKNK2CYP3A4HDAC3NCOR1 | |
| SCHEMBL27836360 | 0.69 | HDAC1 (0.59) | HDAC1CYP3A4HDAC3HDAC2HDAC11 | |
| SCHEMBL14917848 | 0.67 | HDAC1 (0.61) | HDAC1HDAC8HDAC6 | |
| SCHEMBL167082 | 0.66 | BCAT2 (0.67) | MKNK1MKNK2 | |
| SCHEMBL31227976 | 0.66 | BCAT2 (0.67) | MKNK1MKNK2 | |
| SCHEMBL30514275 | 0.66 | BCAT2 (0.67) | MKNK1MKNK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1735319-A1 | INHIBITORS OF HISTONE DEACETYLASE | Methylgene, Inc. (CA) | 2006-12-27 | — | — | EP | claimed |
| WO-2005092899-A1 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE INC. (CA) | 2005-10-06 | — | — | WO | claimed |