Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.53 |
| ▸ | TEK | Q02763 | 10/20 | 0.40 |
| ▸ | KDR | P35968 | 10/20 | 0.40 |
| ▸ | EPHB4 | P54760 | 4/20 | 0.39 |
| ▸ | CDC7 | O00311 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25350090 | 0.91 | HDAC6 (0.53) | HDAC6TEKKDREPHB4CDC7 | |
| SCHEMBL25351724 | 0.88 | HDAC6 (0.53) | HDAC6TEKKDREPHB4CDC7 | |
| SCHEMBL25348315 | 0.87 | HDAC6 (0.51) | HDAC6TEKKDREPHB4HDAC1 | |
| SCHEMBL24216626 | 0.86 | HDAC6 (0.39) | HDAC6HDAC1 | |
| SCHEMBL31535166 | 0.85 | HDAC6 (0.51) | HDAC6TEKKDREPHB4CDC7 | |
| SCHEMBL24216393 | 0.85 | HDAC6 (0.51) | HDAC6TEKKDREPHB4CDC7 | |
| SCHEMBL25355437 | 0.85 | HDAC6 (0.52) | HDAC6TEKKDREPHB4CDC7 | |
| SCHEMBL25993098 | 0.85 | HDAC6 (0.49) | HDAC6TEKKDREPHB4HDAC1 | |
| SCHEMBL24216687 | 0.83 | HDAC6 (0.51) | HDAC6TEKKDREPHB4CDC7 | |
| SCHEMBL30409410 | 0.83 | HDAC6 (0.51) | HDAC6TEKKDREPHB4CDC7 |
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-2022013728-A1 | NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP. (KR) | 2022-01-20 | — | — | WO | disclosed |