Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | BLK | P51451 | 1/20 | 0.44 |
| ▸ | BTK | Q06187 | 1/20 | 0.43 |
| ▸ | FGFR4 | P22455 | 3/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28506021 | 0.79 | HDAC6 (0.52) | HDAC6HDAC1BLKBTKFGFR4 | |
| SCHEMBL28514369 | 0.75 | HDAC1 (0.47) | HDAC6HDAC1 | |
| SCHEMBL28500882 | 0.74 | MEN1 (0.68) | HDAC6HDAC1BLKBTKNOTUM | |
| SCHEMBL6878592 | 0.73 | HDAC6 (0.53) | HDAC6HDAC1 | |
| SCHEMBL28500864 | 0.72 | HDAC1 (0.47) | HDAC6HDAC1NOTUM | |
| SCHEMBL28495217 | 0.72 | HDAC6 (0.70) | HDAC6HDAC1NOTUM | |
| SCHEMBL28500879 | 0.72 | ALDH1A1 (0.56) | HDAC6 | |
| SCHEMBL29558801 | 0.72 | ALDH1A1 (0.56) | HDAC6 | |
| SCHEMBL6879260 | 0.70 | HDAC6 (0.51) | HDAC6HDAC1 | |
| SCHEMBL28495207 | 0.70 | ABCG2 (0.49) | HDAC6HDAC1EGFR |
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 |
|---|---|---|---|---|---|---|---|
| CN-111943892-B | Histone deacetylase subtype inhibitor thioacetylarylamine compound and application thereof | 上海中泽医药科技有限公司 | 2022-04-05 | — | — | CN | disclosed |
| CN-111943892-A | Histone deacetylase subtype inhibitor thioacetylarylamine compound and application thereof | 上海中泽医药科技有限公司 | 2020-11-17 | — | — | CN | disclosed |