Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 5/20 | 0.45 |
| ▸ | RARA | P10276 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.39 |
| ▸ | ACACB | O00763 | 6/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19999455 | 0.89 | NPC1 (0.40) | FFAR1FFAR4MCHR1ACACB | |
| SCHEMBL20005281 | 0.88 | RARA (0.40) | RARBRARAMCHR1ACACBCHRM1 | |
| SCHEMBL19999491 | 0.86 | ACACB (0.47) | RARBRARAMCHR1ACACB | |
| SCHEMBL20004754 | 0.83 | ACACB (0.40) | RARBRARACYP2D6ACACBCYP1A2 | |
| SCHEMBL19999622 | 0.82 | RARA (0.38) | RARBRARAFFAR1FFAR4MCHR1 | |
| SCHEMBL20004614 | 0.81 | RARB (0.41) | RARBRARAFFAR1FFAR4CYP3A4 | |
| SCHEMBL19999364 | 0.81 | ACACB (0.43) | RARBRARAACACB | |
| SCHEMBL8767188 | 0.80 | RARB (0.45) | RARBRARAFFAR1FFAR4CYP3A4 | |
| SCHEMBL20004756 | 0.79 | ACACB (0.43) | RARBRARAFFAR1ACACBHTR2A | |
| SCHEMBL8755463 | 0.79 | MAPT (0.43) | RARBRARAFFAR1FFAR4CYP3A4 |
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-3299439-A1 | LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC Corporation (JP) | 2018-03-28 | — | — | EP | disclosed |