Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | POLA1 | P09884 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 2/20 | 0.33 |
| ▸ | PPARA | Q07869 | 2/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ASAH2 | Q9NR71 | 1/20 | 0.32 |
| ▸ | SOAT2 | O75908 | 1/20 | 0.32 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.32 |
| ▸ | EP300 | Q09472 | 1/20 | 0.32 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.32 |
| ▸ | PSMA7 | O14818 | 1/20 | 0.32 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.32 |
| ▸ | PSMA1 | P25786 | 1/20 | 0.32 |
| ▸ | PSMA2 | P25787 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28340556 | 0.89 | POLB (0.35) | HRH3ALDH1A1POLBPOLA1PPARG | |
| SCHEMBL28340384 | 0.84 | HRH3 (0.40) | HRH3ALDH1A1POLBPPARGPPARA | |
| SCHEMBL9462966 | 0.71 | ALDH1A1 (0.61) | HRH3ALDH1A1PPARGPPARA | |
| SCHEMBL11260061 | 0.70 | HRH3 (0.71) | HRH3POLBPPARGPPARATP53 | |
| SCHEMBL11260057 | 0.70 | HRH3 (0.71) | HRH3POLBPPARGPPARATP53 | |
| Bromide SCHEMBL2169637 | 0.69 | HRH3 (0.69) | HRH3POLBPPARGPPARATP53 | |
| SCHEMBL24507360 | 0.69 | HSP90AA1 (0.59) | HRH3ALDH1A1PPARGPPARA | |
| SCHEMBL12057493 | 0.69 | HSP90AA1 (0.59) | HRH3ALDH1A1PPARGPPARA | |
| SCHEMBL12920382 | 0.69 | HSP90AA1 (0.59) | HRH3ALDH1A1PPARGPPARA | |
| SCHEMBL23378025 | 0.69 | HSP90AA1 (0.59) | HRH3ALDH1A1PPARGPPARA |
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 |
|---|---|---|---|---|---|---|---|
| CN-110642737-B | Preparation method of amide-substituted (E, E) -configuration branched conjugated diene derivative | 杭州师范大学 | 2022-08-05 | — | — | CN | disclosed |
| CN-110642737-A | Amide-substituted (E, E) -configuration branched conjugated diene derivative and preparation method thereof | 杭州师范大学 | 2020-01-03 | — | — | CN | disclosed |