Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 2/20 | 0.36 |
| ▸ | RARA | P10276 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.33 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 8/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 8/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.32 |
| ▸ | ACACB | O00763 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19999400 | 0.82 | — | — | |
| SCHEMBL20004548 | 0.80 | DRD2 (0.40) | KDM4EGAAHPGDACACB | |
| SCHEMBL20004632 | 0.79 | RARA (0.33) | RARBRARACYP2D6CYP3A4KDM4E | |
| SCHEMBL20005218 | 0.79 | RARA (0.36) | RARBRARAMAOBCYP2D6CYP3A4 | |
| SCHEMBL19999608 | 0.78 | HMOX1 (0.35) | RARBRARACYSLTR2CYSLTR1ACACB | |
| SCHEMBL20004622 | 0.78 | MCHR1 (0.40) | RARBRARAMAOBCYP2D6CYP3A4 | |
| SCHEMBL20004766 | 0.76 | MAPT (0.39) | RARBRARAMAOBMCHR1GAA | |
| SCHEMBL19999600 | 0.76 | RARB (0.35) | RARBRARA | |
| SCHEMBL19999409 | 0.75 | ACACB (0.40) | RARBRARACYP3A4ACACB | |
| SCHEMBL19999353 | 0.75 | ACACB (0.48) | RARBRARAMCHR1CHRM1HTR2A |
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 |