Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 15/20 | 1.00 |
| ▸ | HDAC3 | O15379 | 14/20 | 1.00 |
| ▸ | HDAC2 | Q92769 | 14/20 | 1.00 |
| ▸ | NAMPT | P43490 | 6/20 | 1.00 |
| ▸ | NCOR2 | Q9Y618 | 4/20 | 1.00 |
| ▸ | HDAC4 | P56524 | 10/20 | 0.71 |
| ▸ | HDAC7 | Q8WUI4 | 10/20 | 0.71 |
| ▸ | HDAC10 | Q969S8 | 10/20 | 0.71 |
| ▸ | HDAC11 | Q96DB2 | 10/20 | 0.71 |
| ▸ | HDAC8 | Q9BY41 | 10/20 | 0.71 |
| ▸ | HDAC6 | Q9UBN7 | 10/20 | 0.71 |
| ▸ | HDAC9 | Q9UKV0 | 10/20 | 0.71 |
| ▸ | HDAC5 | Q9UQL6 | 10/20 | 0.71 |
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 | |
|---|---|---|---|---|
| SCHEMBL30180504 | 1.00 | HDAC1 (1.00) | HDAC1HDAC3HDAC2NAMPTNCOR2 | |
| Cadaverine Tartrate SCHEMBL28405832 | 0.94 | HDAC3 (0.88) | HDAC1HDAC3HDAC2NAMPTNCOR2 | |
| SCHEMBL23389980 | 0.88 | NAMPT (1.00) | HDAC1HDAC3HDAC2NAMPTNCOR2 | |
| Hydrochloric Acid SCHEMBL29485109 | 0.87 | NAMPT (0.98) | HDAC1HDAC3HDAC2NAMPTNCOR2 | |
| SCHEMBL25003372 | 0.87 | HDAC3 (0.76) | HDAC1HDAC3HDAC2NAMPTNCOR2 | |
| SCHEMBL28410667 | 0.86 | HDAC3 (0.76) | HDAC1HDAC3HDAC2NAMPTNCOR2 | |
| SCHEMBL16212704 | 0.80 | HDAC3 (0.77) | HDAC1HDAC3HDAC2NAMPTNCOR2 | |
| SCHEMBL16212693 | 0.80 | HDAC3 (0.77) | HDAC1HDAC3HDAC2NAMPTNCOR2 | |
| SCHEMBL16212896 | 0.80 | HDAC3 (0.77) | HDAC1HDAC3HDAC2NAMPTNCOR2 | |
| SCHEMBL16212558 | 0.78 | NAMPT (0.71) | HDAC1HDAC3HDAC2NAMPTNCOR2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115703736-A | Multi-target inhibitors targeting HDAC and NAD synthesis and uses thereof | 中国海洋大学 | 2023-02-17 | — | — | CN | claimed |
| CN-115703736-A | Multi-target inhibitors targeting HDAC and NAD synthesis and uses thereof | 中国海洋大学 | 2023-02-17 | — | — | CN | disclosed |
| WO-2023011416-A1 | MULTI-TARGET INHIBITOR TARGETING HDAC AND NAD SYNTHESIS AND USE OF MULTI-TARGET INHIBITOR | 中国海洋大学 | 2023-02-09 | — | — | WO | disclosed |
| CN-106916101-B | NAMPT/HDAC double-target inhibitor and preparation method thereof | 聚缘（上海）生物科技有限公司 | 2020-05-01 | — | — | CN | disclosed |