Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 7/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ACACA | Q13085 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RARA | P10276 | 1/20 | 0.35 |
| ▸ | RARB | P10826 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20005209 | 0.94 | MCHR1 (0.36) | ACACBMAPTACACAALDH1A1GAA | |
| SCHEMBL20004766 | 0.94 | MAPT (0.39) | ACACBMAPTALDH1A1GAAMAPK1 | |
| SCHEMBL20005219 | 0.92 | HMOX1 (0.38) | ACACBACACARARARARBMCHR1 | |
| SCHEMBL20004905 | 0.90 | ESR1 (0.34) | GRM5 | |
| SCHEMBL19999621 | 0.89 | ACACB (0.39) | ACACBACACARARARARBMCHR1 | |
| SCHEMBL20004622 | 0.87 | MCHR1 (0.40) | ACACBMAPTRARARARBMCHR1 | |
| SCHEMBL20004900 | 0.85 | HRH3 (0.36) | MAPK1RARARARBNPC1RAB9A | |
| SCHEMBL20004904 | 0.85 | ESR1 (0.38) | MAPTGRM5AKR1C3AKR1C2 | |
| SCHEMBL20004890 | 0.84 | CYP1A2 (0.35) | MAPTGRM5 | |
| SCHEMBL19999622 | 0.84 | RARA (0.38) | ACACBACACARARARARBMCHR1 |
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 |