Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHKA | P35790 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | BACE1 | P56817 | 3/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | MPL | P40238 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9419251 | 0.83 | TRPA1 (0.44) | CHKAARBACE1ALDH1A1ALOX5 | |
| SCHEMBL3272921 | 0.80 | CNR1 (0.50) | CA2BACE1CYP3A4ALOX5MPL | |
| SCHEMBL8831992 | 0.79 | ESR1 (0.48) | ARCA1CA2ESR1ESR2 | |
| SCHEMBL30694739 | 0.79 | ESR1 (0.48) | ARCA1CA2ESR1ESR2 | |
| SCHEMBL19824580 | 0.79 | MCL1 (0.49) | CA2BACE1CYP3A4ALOX5MPL | |
| SCHEMBL9562136 | 0.79 | GABRA1 (0.51) | ARCYP3A4ESR1ESR2KDM4E | |
| SCHEMBL9405680 | 0.76 | RARB (0.52) | CYP3A4ESR1KDM4EALDH1A1MAPT | |
| SCHEMBL19884557 | 0.76 | GABRA1 (0.38) | ARBACE1ESR1ESR2KDM4E | |
| SCHEMBL19824468 | 0.76 | ALOX5 (0.48) | BACE1ESR1ESR2KDM4EALDH1A1 | |
| SCHEMBL9419257 | 0.76 | COMT (0.45) | ARBACE1PTGS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3526308-B1 | LIQUID-CRYSTALLINE MEDIUM, LIQUID CRYSTAL COMPOUND AND LIQUID-CRYSTAL DISPLAY DEVICE COMPRISING THE SAME | MERCK PATENT GMBH (DE) | 2021-05-19 | — | — | EP | disclosed |
| WO-2018073151-A1 | LIQUID-CRYSTALLINE MEDIUM, LIQUID CRYSTAL COMPOUND AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME | MERCK PATENT GMBH (DE) | 2018-04-26 | — | — | WO | disclosed |
| EP-3299438-A1 | LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME | Merck Patent GmbH (DE) | 2018-03-28 | — | — | EP | disclosed |