Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 3/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.32 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | CLK1 | P49759 | 1/20 | 0.31 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.31 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 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 | |
|---|---|---|---|---|
| SCHEMBL19985412 | 0.89 | ESR2 (0.35) | FFAR4 | |
| SCHEMBL19985421 | 0.87 | FFAR4 (0.32) | CYP3A4CYP2C9FFAR4 | |
| SCHEMBL19985436 | 0.86 | CYP2C9 (0.39) | CYP2C9FFAR4DGAT1MAPTKMT2A | |
| SCHEMBL19986350 | 0.85 | CYP3A4 (0.37) | CYP3A4CYP2C9APPFFAR4S1PR1 | |
| SCHEMBL15681366 | 0.85 | CYP3A4 (0.43) | CYP3A4CYP2C9APPFFAR4S1PR1 | |
| SCHEMBL19985432 | 0.84 | CYP2C9 (0.35) | CYP2C9FFAR4DGAT1MAPTKMT2A | |
| SCHEMBL16769035 | 0.83 | CYP3A4 (0.41) | CYP3A4CYP2C9APPFFAR4S1PR1 | |
| SCHEMBL19986386 | 0.83 | PTGDR2 (0.36) | FEN1ALOX5APPTGDRPTGDR2 | |
| SCHEMBL19985442 | 0.83 | CYP2C9 (0.34) | CYP2C9FFAR4DGAT1GAAMAPT | |
| SCHEMBL19985446 | 0.82 | CYP2C9 (0.34) | CYP2C9FFAR4DGAT1GAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-20180079959-A1 | LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY | DIC CORPORATION (JP) | 2018-03-22 | — | — | US | disclosed |