Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 4/20 | 0.38 |
| ▸ | QPCT | Q16769 | 3/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | GALR1 | P47211 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESRRG | P62508 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22872129 | 0.85 | ESR2 (0.44) | QPCTHTR2CESR2 | |
| SCHEMBL23346032 | 0.81 | CYP2C9 (0.47) | QPCTMAPTKMT2ACYP3A4CYP2C9 | |
| SCHEMBL22872142 | 0.81 | CYP3A4 (0.42) | S1PR1QPCTHSP90AA1GAAMAPT | |
| SCHEMBL23552119 | 0.79 | QPCT (0.43) | S1PR1QPCTPDK2HTR2CCYP3A4 | |
| SCHEMBL23346047 | 0.78 | PDK2 (0.34) | QPCTPDK2HTR2CCYP3A4CYP2C9 | |
| SCHEMBL23542784 | 0.76 | QPCT (0.35) | QPCTHTR2CCYP3A4CYP2C9 | |
| SCHEMBL22872140 | 0.75 | QPCT (0.43) | QPCTPDK2CYP3A4CYP2C9ESR1 | |
| SCHEMBL23817068 | 0.73 | HTR2C (0.59) | S1PR1NOTUMHSP90AA1GAAMAPT | |
| SCHEMBL59138 | 0.71 | NOTUM (0.55) | S1PR1NOTUMHSP90AA1GAAMAPT | |
| SCHEMBL6261107 | 0.71 | KMT2A (0.57) | HSP90AA1GAAMAPTKMT2ATDP1 |
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 2 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 |