Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | PPARA | Q07869 | 3/20 | 0.67 |
| ▸ | PPARG | P37231 | 1/20 | 0.67 |
| ▸ | PPARD | Q03181 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 4/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.64 |
| ▸ | MEN1 | O00255 | 3/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.64 |
| ▸ | GAA | P10253 | 1/20 | 0.64 |
| ▸ | HTT | P42858 | 1/20 | 0.64 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.61 |
| ▸ | AR | P10275 | 1/20 | 0.61 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29238218 | 0.89 | PTGES (0.58) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL7755605 | 0.89 | PTGES (0.58) | ALDH1A1PPARAPPARGPPARDMAPT | |
| Allyleugenol SCHEMBL29401211 | 0.86 | ALDH1A1 (0.77) | ALDH1A1PPARAPPARGPPARDMAPT | |
| Allyleugenol SCHEMBL2779960 | 0.86 | ALDH1A1 (0.77) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL10536924 | 0.85 | ALDH1A1 (0.75) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL10536929 | 0.85 | ALDH1A1 (0.75) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL5002325 | 0.82 | ALDH1A1 (0.71) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL375372 | 0.82 | ALDH1A1 (0.75) | ALDH1A1PPARAPPARGPPARDMAPT | |
| SCHEMBL10536910 | 0.82 | ALDH1A1 (0.80) | ALDH1A1PPARAPPARGPPARDMAPT | |
| Methyleugenol SCHEMBL1869396 | 0.81 | 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-2019030643-A1 | COMPOSITIONS OF EUGENOL DERIVATIVES FOR TREATMENT OF VISCERAL LEISHMANIASIS | FOUNDATION FOR NEGLECTED DISEASE RESEARCH (IN) | 2019-02-14 | — | — | WO | disclosed |