Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 5/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.32 |
| ▸ | FURIN | P09958 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12437039 | 0.91 | THRB (0.50) | THRBTSHRHPGDALDH1A1CYP3A4 | |
| SCHEMBL12436997 | 0.90 | THRB (0.41) | THRBTSHRHPGDALDH1A1CYP3A4 | |
| SCHEMBL16133506 | 0.88 | THRB (0.39) | THRBTSHRHPGDALDH1A1CYP3A4 | |
| SCHEMBL19821125 | 0.86 | THRB (0.52) | THRBTSHRHPGDALDH1A1CYP3A4 | |
| SCHEMBL14907431 | 0.85 | THRB (0.45) | THRBTSHRHPGDALDH1A1CYP3A4 | |
| SCHEMBL14907509 | 0.85 | THRB (0.45) | THRBTSHRHPGDALDH1A1CYP3A4 | |
| SCHEMBL12437000 | 0.85 | THRB (0.45) | THRBTSHRHPGDALDH1A1CYP3A4 | |
| SCHEMBL14907503 | 0.84 | THRB (0.46) | THRBTSHRHPGDALDH1A1CYP3A4 | |
| SCHEMBL14302569 | 0.83 | THRB (0.45) | THRBTSHRHPGDALDH1A1CYP3A4 | |
| SCHEMBL12437036 | 0.83 | THRB (0.42) | THRBTSHRHPGDALDH1A1CYP3A4 |
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-2771735-B1 | SWITCH ELEMENT COMPRISING A LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2018-01-24 | — | — | EP | disclosed |