Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 7/20 | 0.71 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.67 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.67 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.67 |
| ▸ | NCOR2 | Q9Y618 | 3/20 | 0.67 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.67 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.67 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.67 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.67 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.67 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.67 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.67 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.56 |
| ▸ | DRD2 | P14416 | 1/20 | 0.56 |
| ▸ | DRD4 | P21917 | 1/20 | 0.56 |
| ▸ | DRD3 | P35462 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL13749827 | 0.99 | NAMPT (0.69) | NAMPTHDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL16212709 | 0.89 | NAMPT (0.83) | NAMPTHDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL16212873 | 0.89 | NAMPT (0.83) | NAMPTHDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL12396047 | 0.89 | NAMPT (0.62) | NAMPTHDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL16212558 | 0.86 | NAMPT (0.71) | NAMPTHDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL16212713 | 0.86 | NAMPT (0.75) | NAMPTHDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL16213049 | 0.86 | NAMPT (0.71) | NAMPTHDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL16212516 | 0.86 | NAMPT (0.71) | NAMPTHDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL16212722 | 0.86 | NAMPT (0.71) | NAMPTHDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL16212363 | 0.86 | NAMPT (0.75) | NAMPTHDAC3HDAC1HDAC2NCOR2 |
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-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 |