Known targets — ChEMBL curated mechanism
CHRM1DRD2DRD3DRD4HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR2APDE3ASIGMAR1
The experimentally established mechanism targets of Niacinamide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 known ✓ | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC6 known ✓ | Q9UBN7 | 1/20 | 0.46 |
| ▸ | F7 | P08709 | 1/20 | 0.73 |
| ▸ | F3 | P13726 | 1/20 | 0.73 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.73 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.73 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.73 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.73 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.73 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.73 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | APP | P05067 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.55 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.55 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.50 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.50 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Niacinamide SCHEMBL74569 | 1.00 | F7 (0.73) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL2480073 | 0.90 | F7 (0.73) | F7F3SARM1SIRT2SIRT6 | |
| Cadaverine Tartrate SCHEMBL29103712 | 0.88 | F7 (0.76) | F7F3SARM1SIRT2SIRT6 | |
| Cadaverine Tartrate SCHEMBL27679158 | 0.88 | F7 (0.76) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL675207 | 0.88 | F7 (0.96) | F7F3SARM1SIRT2SIRT6 | |
| Niacin SCHEMBL811678 | 0.86 | ALDH1A1 (0.75) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL18443774 | 0.86 | F7 (0.85) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL28307211 | 0.86 | F7 (0.85) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL8462317 | 0.86 | F7 (0.67) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL27671762 | 0.86 | F7 (0.92) | F7F3SARM1SIRT2SIRT6 |
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 |
|---|---|---|---|---|---|---|---|
| US-20040228884-A1 | Ion-pair delivery system for cosmetic and pharmaceutical compositions | GUPTA SHYAM K (US) | 2004-11-18 | — | — | US | disclosed |