Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.54 |
| ▸ | SRC | P12931 | 1/20 | 0.54 |
| ▸ | KDR | P35968 | 1/20 | 0.54 |
| ▸ | PI4KA | P42356 | 1/20 | 0.44 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.44 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.44 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.44 |
| ▸ | F7 | P08709 | 1/20 | 0.42 |
| ▸ | F3 | P13726 | 1/20 | 0.42 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.42 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.42 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.42 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.42 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.42 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.42 |
| ▸ | CHKA | P35790 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 SCHEMBL22748485 | 0.80 | EGFR (0.65) | EGFRSRCKDRPI4KAPI4K2B | |
| SCHEMBL3802976 | 0.79 | EGFR (0.61) | EGFRSRCKDRPI4KAPI4K2B | |
| Niacinamide SCHEMBL28597484 | 0.79 | EGFR (0.61) | EGFRSRCKDRPI4KAPI4K2B | |
| Niacinamide SCHEMBL23531100 | 0.77 | EGFR (0.61) | EGFRSRCKDRPI4KAPI4K2B | |
| Niacinamide SCHEMBL27560268 | 0.77 | EGFR (0.78) | EGFRSRCKDRPI4KAPI4K2B | |
| Niacinamide SCHEMBL27691155 | 0.74 | EGFR (0.67) | EGFRSRCKDRPI4KAPI4K2B | |
| Niacinamide SCHEMBL28207961 | 0.73 | F7 (0.73) | F7F3SARM1SIRT2SIRT6 | |
| Niacinamide SCHEMBL27733580 | 0.73 | EGFR (0.52) | EGFRSRCKDRPI4KAPI4K2B | |
| SCHEMBL21066915 | 0.71 | EGFR (0.65) | EGFRSRCKDRPI4KAPI4K2B | |
| SCHEMBL1271540 | 0.71 | EGFR (0.61) | EGFRSRCKDRPI4KAPI4K2B |
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-101316810-A | Ionic liquids | BIONIQS LTD (GB) | 2008-12-03 | — | — | CN | disclosed |