Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | IAPP | P10997 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 6/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29722134 | 0.89 | PTGS1 (0.41) | PTGS1PTGS2IAPPAPPGABRA1 | |
| SCHEMBL28720493 | 0.86 | PTGS1 (0.41) | PTGS1PTGS2IAPPAPPGABRA1 | |
| SCHEMBL8847721 | 0.84 | MMP2 (0.46) | PTGS1PTGS2IAPPAPPALDH1A1 | |
| SCHEMBL8847717 | 0.84 | MMP2 (0.46) | PTGS1PTGS2IAPPAPPALDH1A1 | |
| SCHEMBL28734335 | 0.83 | CYP1A2 (0.34) | CYP3A4 | |
| SCHEMBL9682413 | 0.80 | IAPP (0.59) | PTGS1IAPPAPPALDH1A1CYP3A4 | |
| SCHEMBL8847575 | 0.80 | IAPP (0.59) | PTGS1IAPPAPPALDH1A1CYP3A4 | |
| SCHEMBL29466172 | 0.79 | TYR (0.59) | PTGS1PTGS2APPALDH1A1CYP3A4 | |
| SCHEMBL6056802 | 0.77 | BACE1 (0.48) | IAPPAPPALDH1A1CYP3A4RECQL | |
| SCHEMBL6056797 | 0.77 | BACE1 (0.48) | IAPPAPPALDH1A1CYP3A4RECQL |
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-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 |