Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 5/20 | 0.57 |
| ▸ | BACE1 | P56817 | 4/20 | 0.57 |
| ▸ | MAOB | P27338 | 2/20 | 0.56 |
| ▸ | MMP1 | P03956 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | APP | P05067 | 1/20 | 0.52 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.50 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8317320 | 0.91 | GSK3B (0.58) | GSK3BBACE1MAOBMMP1NPC1 | |
| SCHEMBL8320471 | 0.89 | GSK3B (0.52) | GSK3BBACE1MAOBMMP1NPC1 | |
| SCHEMBL8317289 | 0.89 | MMP1 (0.55) | GSK3BBACE1MAOBMMP1NPC1 | |
| SCHEMBL527827 | 0.83 | GSK3B (0.80) | GSK3BBACE1MAOBNPC1RAB9A | |
| SCHEMBL8740053 | 0.83 | GSK3B (0.80) | GSK3BBACE1MAOBNPC1RAB9A | |
| SCHEMBL527828 | 0.83 | GSK3B (0.80) | GSK3BBACE1MAOBNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL7054738 | 0.82 | GSK3B (0.78) | GSK3BBACE1MAOBNPC1RAB9A | |
| SCHEMBL5947456 | 0.80 | KDM4E (0.71) | GSK3BBACE1MAOBNPC1RAB9A | |
| SCHEMBL5947453 | 0.80 | KDM4E (0.71) | GSK3BBACE1MAOBNPC1RAB9A | |
| SCHEMBL15239146 | 0.79 | THRB (0.73) | GSK3BBACE1MAOBNPC1RAB9A |
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-2004071401-A2 | HYDROXAMIC ACID DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS (HDCA) | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-08-26 | — | — | WO | disclosed |