Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 3/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | RARB | P10826 | 5/20 | 0.35 |
| ▸ | RARA | P10276 | 1/20 | 0.34 |
| ▸ | HRH2 | P25021 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 5/20 | 0.32 |
| ▸ | CNR2 | P34972 | 5/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.31 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | HTR1B | P28222 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL20313549 | 0.85 | RARB (0.37) | ITGB3ITGA2BPDE4APDE4DRARB | |
| SCHEMBL20407572 | 0.85 | RAB9A (0.36) | ITGB3ITGA2BPDE4APDE4DCYP3A4 | |
| SCHEMBL20407624 | 0.85 | ITGB3 (0.37) | ITGB3ITGA2BCYP3A4CYP2D6CNR1 | |
| SCHEMBL20407382 | 0.81 | S1PR3 (0.33) | ITGB3ITGA2BCNR1CNR2 | |
| SCHEMBL20407589 | 0.80 | RARA (0.36) | ITGB3ITGA2BRARBRARAFFAR4 | |
| SCHEMBL23635492 | 0.80 | RARB (0.33) | ITGB3ITGA2BPDE4APDE4DRARB | |
| SCHEMBL20407605 | 0.80 | ITGB3 (0.34) | ITGB3ITGA2BPDE4APDE4DRARB | |
| SCHEMBL20407665 | 0.80 | ITGB3 (0.31) | ITGB3ITGA2BPDE4APDE4DCNR1 | |
| SCHEMBL20322593 | 0.79 | ITGB3 (0.33) | ITGB3ITGA2BRARBRARA | |
| SCHEMBL20407510 | 0.78 | CNR1 (0.36) | ITGB3ITGA2BCYP3A4CNR1CNR2 |
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-3351525-A1 | POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | JNC Corporation (JP) | 2018-07-25 | — | — | EP | disclosed |