Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.78 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.78 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.38 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL28509075 | 0.88 | HDAC6 (1.00) | HDAC1HDAC6ALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL28504752 | 0.78 | HDAC1 (0.58) | HDAC1HDAC6ALDH1A1SMN1; SMN2GAA | |
| SCHEMBL28502726 | 0.76 | HDAC1 (0.70) | HDAC1HDAC6SMN1; SMN2MAPK1KMT2A | |
| SCHEMBL28495217 | 0.76 | HDAC6 (0.70) | HDAC1HDAC6KMT2AMEN1POLB | |
| SCHEMBL28504784 | 0.75 | HDAC1 (0.69) | HDAC1HDAC6SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL5804257 | 0.74 | GAA (0.63) | HDAC1HDAC6ALDH1A1SMN1; SMN2GAA | |
| SCHEMBL28504884 | 0.73 | HDAC6 (0.75) | HDAC1HDAC6SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL2567160 | 0.72 | ALDH1A1 (0.43) | HDAC1HDAC6ALDH1A1MAPK1KMT2A | |
| SCHEMBL29558905 | 0.72 | HDAC1 (0.72) | HDAC1HDAC6SMN1; SMN2GAAKMT2A | |
| SCHEMBL29558498 | 0.72 | HDAC6 (0.71) | HDAC1HDAC6ALDH1A1SMN1; SMN2KMT2A |
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 |