Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.80 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.74 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.74 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.74 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.74 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.74 |
| ▸ | STAT3 | P40763 | 2/20 | 0.74 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.74 |
| ▸ | RELA | Q04206 | 2/20 | 0.74 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.74 |
| ▸ | CA12 | O43570 | 3/20 | 0.72 |
| ▸ | CA4 | P22748 | 3/20 | 0.72 |
| ▸ | CA6 | P23280 | 3/20 | 0.72 |
| ▸ | CA5A | P35218 | 3/20 | 0.72 |
| ▸ | CA7 | P43166 | 3/20 | 0.72 |
| ▸ | CA9 | Q16790 | 3/20 | 0.72 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.72 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.72 |
| ▸ | APP | P05067 | 3/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.72 |
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 | |
|---|---|---|---|---|
| Methyl Cis-Ferulate SCHEMBL29406729 | 0.89 | EPHX2 (1.00) | EPHX2CYP2D6CYP1A2ALOX5NFKB1 | |
| Methyl Cis-Ferulate SCHEMBL2085720 | 0.89 | EPHX2 (1.00) | EPHX2CYP2D6CYP1A2ALOX5NFKB1 | |
| SCHEMBL3043673 | 0.89 | EPHX2 (0.82) | EPHX2CYP2D6CYP1A2ALOX5NFKB1 | |
| Methyl Cis-Ferulate SCHEMBL510492 | 0.89 | EPHX2 (1.00) | EPHX2CYP2D6CYP1A2ALOX5NFKB1 | |
| SCHEMBL30073323 | 0.88 | EPHX2 (0.80) | EPHX2CYP2D6CYP1A2ALOX5NFKB1 | |
| Methyl Cis-Ferulate SCHEMBL30211782 | 0.88 | EPHX2 (0.97) | EPHX2CYP2D6CYP1A2ALOX5NFKB1 | |
| Methyl Cis-Ferulate SCHEMBL28056966 | 0.88 | EPHX2 (0.97) | EPHX2CYP2D6CYP1A2ALOX5NFKB1 | |
| SCHEMBL11758451 | 0.86 | EPHX2 (0.78) | EPHX2CYP2D6CYP1A2ALOX5NFKB1 | |
| SCHEMBL29478095 | 0.85 | CYP2D6 (1.00) | EPHX2CYP2D6CYP1A2ALOX5NFKB1 | |
| SCHEMBL1493282 | 0.85 | CYP2D6 (1.00) | EPHX2CYP2D6CYP1A2ALOX5NFKB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3750904-A1 | THERAPEUTIC DRUG FOR NEURODEGENERATIVE DISEASE AND APPLICATION THEREOF | Shanghai Dongxi Zhihui Biological Medicine Co., Ltd. (CN) | 2020-12-16 | — | — | EP | disclosed |