Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.65 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.65 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.59 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.57 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | APP | P05067 | 1/20 | 0.55 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.55 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.55 |
| ▸ | F7 | P08709 | 1/20 | 0.53 |
| ▸ | F3 | P13726 | 1/20 | 0.53 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.53 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.53 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.53 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL23778469 | 1.00 | HDAC1 (0.65) | HDAC1HDAC6LMNATHRBHIF1A | |
| SCHEMBL2988299 | 0.81 | HDAC1 (0.65) | HDAC1HDAC6LMNATHRBHIF1A | |
| SCHEMBL3821696 | 0.81 | HDAC1 (0.69) | HDAC1HDAC6LMNATHRBHIF1A | |
| Nicotinyl Methylamide SCHEMBL28560459 | 0.81 | HDAC1 (0.69) | HDAC1HDAC6LMNATHRBHIF1A | |
| Nicotinyl Methylamide SCHEMBL30664356 | 0.81 | HDAC1 (0.69) | HDAC1HDAC6LMNATHRBHIF1A | |
| Nicotinyl Methylamide SCHEMBL129458 | 0.81 | HDAC1 (0.69) | HDAC1HDAC6LMNATHRBHIF1A | |
| SCHEMBL2000041 | 0.80 | HDAC1 (0.74) | HDAC1HDAC6LMNATHRBHIF1A | |
| SCHEMBL5361880 | 0.80 | HDAC1 (0.74) | HDAC1HDAC6LMNATHRBHIF1A | |
| Iodide SCHEMBL28221159 | 0.80 | HDAC1 (0.62) | HDAC1HDAC6LMNATHRBHIF1A | |
| Nicotinyl Methylamide SCHEMBL5528294 | 0.79 | HDAC1 (0.67) | HDAC1HDAC6LMNATHRBHIF1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-112955115-B | Bioenergy glyceryl nicotinate, compositions and methods of using the same | 联合利华知识产权控股有限公司 | 2023-06-30 | — | — | CN | disclosed |