Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 15/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.47 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 2/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3548819 | 0.91 | HDAC1 (0.63) | PTGS1HDAC1HDAC2 | |
| SCHEMBL3555022 | 0.83 | HDAC1 (0.61) | PTGS1HDAC1 | |
| SCHEMBL3551914 | 0.78 | HDAC1 (0.61) | PTGS1HDAC1HDAC2 | |
| SCHEMBL4761342 | 0.78 | HDAC1 (0.51) | HDAC1 | |
| SCHEMBL3548329 | 0.77 | HDAC1 (0.63) | PTGS1HDAC1HDAC2 | |
| SCHEMBL3555971 | 0.76 | HDAC1 (0.61) | PTGS1HDAC1 | |
| SCHEMBL3550053 | 0.76 | HDAC1 (0.69) | HDAC1HDAC2 | |
| SCHEMBL3551358 | 0.76 | HDAC2 (0.59) | PTGS1HDAC1HDAC2HDAC3HDAC10 | |
| SCHEMBL3557646 | 0.74 | HDAC1 (0.61) | PTGS1HDAC1HDAC2 | |
| SCHEMBL3554866 | 0.74 | HDAC1 (0.58) | PTGS1HDAC1HDAC2HDAC3HDAC10 |
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-1904452-A2 | HISTONE DEACETYLASE INHIBITORS | Takeda San Diego, Inc. (US) | 2008-04-02 | — | — | EP | claimed |
| WO-2007011626-A2 | HISTONE DEACETYLASE INHIBITORS | TAKEDA SAN DIEGO, INC. (US) | 2007-01-25 | — | — | WO | claimed |