Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D
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 | |
|---|---|---|---|---|
| ▸ | F7 | P08709 | 1/20 | 0.76 |
| ▸ | F3 | P13726 | 1/20 | 0.76 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.76 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.76 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.76 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.76 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.76 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.76 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.76 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | APP | P05067 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.56 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.56 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.53 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.51 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.51 |
| ▸ | TBXAS1 | P24557 | 6/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.47 |
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 SCHEMBL9373225 | 0.89 | F7 (0.96) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL675207 | 0.89 | F7 (0.96) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL2271609 | 0.89 | F7 (0.96) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL28768072 | 0.88 | F7 (0.79) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL810864 | 0.88 | F7 (0.79) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL5712651 | 0.87 | F7 (0.85) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL2926 | 0.87 | — | — | |
| Niacinamide SCHEMBL460466 | 0.87 | F7 (1.00) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL19978192 | 0.87 | — | — | |
| Niacinamide SCHEMBL29624874 | 0.87 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0662830-B1 | (pi)-BOND AROMATIC VITAMIN CHELATES | ALBION INT (US) | 2001-01-24 | — | — | EP | disclosed |
| EP-0662830-A4 | -G(P)-BOND AROMATIC VITAMIN CHELATES. | — | 1995-08-16 | — | — | EP | disclosed |
| EP-0662830-A1 | $g(p)-BOND AROMATIC VITAMIN CHELATES | ALBION INTERNATIONAL, INC. (US) | 1995-07-19 | — | — | EP | disclosed |
| US-5292729-A | Pi bond vitamin-mineral chelates | ALBION INTERNATIONAL, INC. (US) | 1994-03-08 | — | — | US | disclosed |
| WO-1994004141-A1 | π-BOND AROMATIC VITAMIN CHELATES | ALBION INTERNATIONAL, INC. (US) | 1994-03-03 | — | — | WO | disclosed |