Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 14/20 | 0.67 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.60 |
| ▸ | MAOB | P27338 | 2/20 | 0.58 |
| ▸ | MAOA | P21397 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.57 |
| ▸ | BCHE | P06276 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.57 |
| ▸ | RELA | Q04206 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL28598690 | 0.88 | PTGS2 (0.64) | PTGS2PTGS1MAOBMAOANPC1 | |
| SCHEMBL28611043 | 0.86 | PTGS2 (0.62) | PTGS2PTGS1MAOBMAOA | |
| SCHEMBL28605277 | 0.86 | MAOB (0.67) | PTGS2PTGS1MAOBMAOANPC1 | |
| SCHEMBL4610666 | 0.81 | ABCG2 (0.85) | MAOANPC1ALDH1A1MAPTRAB9A | |
| SCHEMBL4610668 | 0.81 | ABCG2 (0.85) | MAOANPC1ALDH1A1MAPTRAB9A | |
| SCHEMBL28603606 | 0.80 | MAOB (0.68) | PTGS2PTGS1MAOBMAOAMAPT | |
| SCHEMBL28426121 | 0.78 | PTGS2 (0.68) | PTGS2PTGS1 | |
| SCHEMBL28184990 | 0.78 | PTGS2 (0.68) | PTGS2PTGS1 | |
| SCHEMBL28421826 | 0.78 | PTGS2 (0.68) | PTGS2PTGS1 | |
| SCHEMBL14837404 | 0.77 | ABCG2 (0.72) | MAOBMAOANPC1ALDH1A1MAPT |
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-108558813-B | Resveratrol derivative containing flavonoid as well as preparation method and application thereof | 合肥工业大学 | 2021-07-23 | — | — | CN | disclosed |