Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.71 |
| ▸ | PPARA | Q07869 | 3/20 | 0.71 |
| ▸ | PPARG | P37231 | 1/20 | 0.71 |
| ▸ | PPARD | Q03181 | 1/20 | 0.71 |
| ▸ | MAPT | P10636 | 5/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.63 |
| ▸ | MEN1 | O00255 | 3/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | LMNA | P02545 | 2/20 | 0.63 |
| ▸ | GAA | P10253 | 2/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.63 |
| ▸ | NPC1 | O15118 | 4/20 | 0.60 |
| ▸ | RAB9A | P51151 | 3/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.58 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.57 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | AR | P10275 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL9721996 | 0.95 | ALDH1A1 (0.77) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL874505 | 0.90 | ALDH1A1 (0.69) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL9615213 | 0.90 | ALDH1A1 (0.69) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL9722118 | 0.87 | ALDH1A1 (0.69) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL8964626 | 0.85 | ALDH1A1 (0.62) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL5802074 | 0.84 | ALDH1A1 (0.78) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL10536910 | 0.84 | ALDH1A1 (0.80) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL10731044 | 0.84 | ALDH1A1 (0.69) | ALDH1A1PPARAPPARGPPARDMAPT | |
| Methyleugenol SCHEMBL1869396 | 0.84 | ALDH1A1 (1.00) | ALDH1A1PPARAPPARGPPARDMAPT | |
| Methyleugenol SCHEMBL113794 | 0.84 | ALDH1A1 (1.00) | ALDH1A1PPARAPPARGPPARDMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019198606-A1 | ALKENYL-GROUP-CONTAINING COMPOUND, CURABLE RESIN COMPOSITION, AND CURED OBJECT OBTAINED THEREFROM | 日本化薬株式会社 | 2019-10-17 | — | — | WO | disclosed |