Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 19/20 | 1.00 |
| ▸ | HDAC1 | Q13547 | 16/20 | 1.00 |
| ▸ | HDAC2 | Q92769 | 16/20 | 1.00 |
| ▸ | NCOR2 | Q9Y618 | 3/20 | 0.69 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.67 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.67 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.67 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.67 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.67 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.67 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.67 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL28918467 | 0.90 | HDAC3 (0.82) | HDAC3HDAC1HDAC2NCOR2HDAC4 | |
| SCHEMBL30141889 | 0.90 | HDAC3 (0.82) | HDAC3HDAC1HDAC2NCOR2HDAC4 | |
| SCHEMBL17141739 | 0.88 | HDAC3 (1.00) | HDAC3HDAC1HDAC2NCOR2HDAC8 | |
| SCHEMBL30141886 | 0.88 | HDAC3 (0.79) | HDAC3HDAC1HDAC2NCOR2HDAC4 | |
| SCHEMBL28961550 | 0.88 | HDAC3 (0.79) | HDAC3HDAC1HDAC2NCOR2HDAC4 | |
| SCHEMBL28918334 | 0.88 | HDAC3 (0.79) | HDAC3HDAC1HDAC2NCOR2HDAC4 | |
| SCHEMBL30141884 | 0.88 | HDAC3 (0.79) | HDAC3HDAC1HDAC2NCOR2HDAC4 | |
| SCHEMBL21435753 | 0.87 | HDAC3 (1.00) | HDAC3HDAC1HDAC2NCOR2HDAC4 | |
| SCHEMBL30141888 | 0.87 | HDAC3 (0.77) | HDAC3HDAC1HDAC2NCOR2HDAC4 | |
| SCHEMBL28918526 | 0.87 | HDAC3 (0.77) | HDAC3HDAC1HDAC2NCOR2HDAC4 |
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-113831338-B | Histone deacetylase inhibitor and preparation method and application thereof | 中国海洋大学 | 2022-12-20 | — | — | CN | disclosed |
| CN-113831338-A | Histone deacetylase inhibitor and preparation method and application thereof | 中国海洋大学 | 2021-12-24 | — | — | CN | disclosed |