Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | QPCT | Q16769 | 2/20 | 0.32 |
| ▸ | KMO | O15229 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | ABCB1 | P08183 | 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 | |
|---|---|---|---|---|
| SCHEMBL22872128 | 0.86 | ESR2 (0.34) | QPCT | |
| SCHEMBL23552119 | 0.83 | QPCT (0.43) | PDK2BACE1QPCTKMOCYP3A4 | |
| SCHEMBL23346029 | 0.83 | CYP2C9 (0.39) | QPCTCYP2C9 | |
| SCHEMBL23542784 | 0.81 | QPCT (0.35) | QPCTCYP3A4CYP2C9HTR2C | |
| SCHEMBL23552205 | 0.78 | S1PR1 (0.38) | PDK2BACE1QPCTCYP3A4CYP2C9 | |
| SCHEMBL22872142 | 0.75 | CYP3A4 (0.42) | PDK2QPCTCYP3A4CYP2C9 | |
| SCHEMBL23346100 | 0.75 | QPCT (0.41) | PDK2QPCTCYP3A4CYP2C9HTR2C | |
| SCHEMBL23346099 | 0.72 | QPCT (0.43) | PDK2QPCTCYP3A4CYP2C9HTR2C | |
| SCHEMBL22872136 | 0.70 | QPCT (0.42) | PDK2QPCTCYP3A4CYP2C9HTR2C | |
| SCHEMBL23542789 | 0.69 | KDM1A (0.36) | QPCT |
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 |
|---|---|---|---|---|---|---|---|
| US-11359142-B2 | Liquid-crystalline medium and liquid-crystal display comprising the same | MERCK PATENT GMBH (DE) | 2022-06-14 | — | — | US | disclosed |
| US-20210189241-A1 | LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME | MERCK PATENT GMBH (DE) | 2021-06-24 | — | — | US | disclosed |
| US-20210139779-A1 | Thiophene compound, liquid-crystalline medium and liquid-crystal display comprising the same | MERCK PATENT GMBH (DE) | 2021-05-13 | — | — | US | disclosed |