Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | APP | P05067 | 2/20 | 0.35 |
| ▸ | FASN | P49327 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | F10 | P00742 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | CHKA | P35790 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8732266 | 1.00 | CYP3A4 (0.35) | CYP3A4CYP2C9APPFASNFFAR4 | |
| SCHEMBL8732276 | 1.00 | CYP3A4 (0.35) | CYP3A4CYP2C9APPFASNFFAR4 | |
| SCHEMBL8732270 | 1.00 | CYP3A4 (0.35) | CYP3A4CYP2C9APPFASNFFAR4 | |
| SCHEMBL8727711 | 0.92 | CYP3A4 (0.36) | CYP3A4CYP2C9APPFASNFFAR4 | |
| SCHEMBL8727704 | 0.92 | CYP3A4 (0.36) | CYP3A4CYP2C9APPFASNFFAR4 | |
| SCHEMBL8727708 | 0.92 | CYP3A4 (0.36) | CYP3A4CYP2C9APPFASNFFAR4 | |
| SCHEMBL8730466 | 0.86 | CYP3A4 (0.35) | CYP3A4CYP2C9APPFASNFFAR4 | |
| SCHEMBL8728207 | 0.84 | HDAC2 (0.36) | CYP3A4CYP2C9L3MBTL1 | |
| SCHEMBL8728203 | 0.84 | HDAC2 (0.36) | CYP3A4CYP2C9L3MBTL1 | |
| SCHEMBL8728211 | 0.84 | HDAC2 (0.36) | CYP3A4CYP2C9L3MBTL1 |
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-0882695-A1 | BENZYL ETHER DERIVATIVES, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY | CHISSO CORPORATION (JP) | 1998-12-09 | — | — | EP | disclosed |