Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | IAPP | P10997 | 2/20 | 0.39 |
| ▸ | APP | P05067 | 8/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | RGS12 | O14924 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28734267 | 0.86 | PTGS1 (0.43) | PTGS1PTGS2IAPPAPPCYP3A4 | |
| SCHEMBL28734308 | 0.84 | HPGD (0.32) | — | |
| SCHEMBL28734356 | 0.84 | CYP1A2 (0.33) | CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL29722134 | 0.84 | PTGS1 (0.41) | PTGS1PTGS2IAPPAPPCYP3A4 | |
| SCHEMBL28734344 | 0.84 | TNNC1 (0.32) | — | |
| SCHEMBL8847717 | 0.81 | MMP2 (0.46) | PTGS1PTGS2IAPPAPPCYP3A4 | |
| SCHEMBL8847721 | 0.81 | MMP2 (0.46) | PTGS1PTGS2IAPPAPPCYP3A4 | |
| SCHEMBL9682413 | 0.78 | IAPP (0.59) | PTGS1IAPPAPPCYP3A4ALDH1A1 | |
| SCHEMBL8847575 | 0.78 | IAPP (0.59) | PTGS1IAPPAPPCYP3A4ALDH1A1 | |
| SCHEMBL6056802 | 0.75 | BACE1 (0.48) | IAPPAPPCYP3A4ALDH1A1RECQL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114380673-A | Dialkoxyalkenylalkoxymethyl ether compounds and process for producing conjugated alkadienal compounds from the same | 信越化学工业株式会社 | 2022-04-22 | — | — | CN | disclosed |
| CN-114380669-A | 6-hydroxy-3-hexenylalkoxymethyl ether compounds and process for preparing 3, 13-octadecadien-1-ol therefrom | 信越化学工业株式会社 | 2022-04-22 | — | — | CN | disclosed |
| CN-114380689-A | Haloalkenylalkoxymethyl ethers and processes for preparing terminally conjugated alkadien-1-yl acetates and alkadien-1-ols therefrom | 信越化学工业株式会社 | 2022-04-22 | — | — | CN | disclosed |