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 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 5/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.57 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.57 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | APP | P05067 | 1/20 | 0.52 |
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 SCHEMBL11742728 | 0.93 | F7 (0.81) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL28756091 | 0.92 | F7 (0.69) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL5712635 | 0.90 | F7 (0.76) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL10977704 | 0.89 | F7 (0.81) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL5712662 | 0.89 | F7 (0.81) | F7F3SARM1SIRT2SIRT6 | |
| Cetostearyl Alcohol SCHEMBL28998932 | 0.89 | F7 (0.65) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL27626287 | 0.89 | F7 (0.65) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL23576525 | 0.89 | F7 (0.96) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL27671762 | 0.87 | F7 (0.92) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL5712652 | 0.87 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1613597-A1 | 6-SUBSTITUTED NICOTINAMIDE DERIVATIVES AS OPIOID RECEPTOR ANTAGONISTS | Eli Lilly and Company (US) | 2006-01-11 | — | — | EP | disclosed |
| WO-2004080968-A1 | 6-SUBSTITUTED NICOTINAMIDE DERIVATIVES AS OPIOID RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 2004-09-23 | — | — | WO | disclosed |