Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.34 |
| ▸ | APP | P05067 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | FASN | P49327 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 1/20 | 0.31 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.30 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.30 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19721877 | 0.90 | CYP3A4 (0.32) | CYP3A4APPCYP2C9FASNRARB | |
| SCHEMBL19853911 | 0.83 | CYP2C9 (0.31) | CYP3A4CYP2C9S1PR3S1PR1CYP2C8 | |
| SCHEMBL19721888 | 0.83 | RARB (0.39) | CYP3A4APPCYP2C9FASNRARB | |
| SCHEMBL19722534 | 0.82 | DRD2 (0.39) | CYP3A4APPCYP2C9FASNRARB | |
| SCHEMBL7759051 | 0.82 | CYP3A4 (0.44) | CYP3A4APPCYP2C9FASNRARB | |
| SCHEMBL4799678 | 0.82 | CYP3A4 (0.44) | CYP3A4APPCYP2C9FASNRARB | |
| SCHEMBL8831427 | 0.82 | CYP3A4 (0.44) | CYP3A4APPCYP2C9FASNRARB | |
| SCHEMBL4799680 | 0.82 | CYP3A4 (0.44) | CYP3A4APPCYP2C9FASNRARB | |
| SCHEMBL19722531 | 0.81 | CYP2C9 (0.38) | CYP3A4APPCYP2C9FASNRARB | |
| SCHEMBL11897212 | 0.81 | FFAR4 (0.38) | CYP3A4APPCYP2C9FASNRARB |
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-3257839-A1 | POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | JNC Corporation (JP) | 2017-12-20 | — | — | EP | disclosed |