Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 3/20 | 0.40 |
| ▸ | ACACB | O00763 | 10/20 | 0.40 |
| ▸ | RARA | P10276 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
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 | 0.91 | MCHR1 (0.36) | MCHR1ACACBRARARARBCHRM1 | |
| SCHEMBL20004766 | 0.91 | MAPT (0.39) | MCHR1ACACBRARARARBCHRM1 | |
| SCHEMBL19999353 | 0.89 | ACACB (0.48) | MCHR1ACACBRARARARBCHRM1 | |
| SCHEMBL19999557 | 0.89 | ACACB (0.42) | MCHR1ACACBRARARARBCHRM1 | |
| SCHEMBL20005281 | 0.88 | RARA (0.40) | MCHR1ACACBRARARARBCHRM1 | |
| SCHEMBL20005270 | 0.87 | ACACB (0.35) | MCHR1ACACBRARARARBCHRM1 | |
| SCHEMBL20005219 | 0.87 | HMOX1 (0.38) | MCHR1ACACBRARARARBCHRM1 | |
| SCHEMBL20005221 | 0.87 | GRM5 (0.37) | MAPTL3MBTL1PTGS2 | |
| SCHEMBL20004637 | 0.87 | GRM5 (0.37) | MAPTL3MBTL1PTGS2 | |
| SCHEMBL20004548 | 0.85 | DRD2 (0.40) | ACACBMAPTTHRBL3MBTL1 |
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 |