Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SCN1A | P35498 | 2/20 | 0.40 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.40 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PLK1 | P53350 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19884601 | 0.91 | TSHR (0.57) | TSHRALDH1A1ESR1HSD17B10GAA | |
| SCHEMBL13554254 | 0.87 | GAA (0.56) | TSHRALDH1A1ESR1HSD17B10GAA | |
| SCHEMBL19884596 | 0.87 | TSHR (0.51) | TSHRALDH1A1ESR1HSD17B10GAA | |
| SCHEMBL19884590 | 0.86 | GAA (0.54) | TSHRALDH1A1ESR1HSD17B10GAA | |
| SCHEMBL19884630 | 0.86 | TSHR (0.52) | TSHRALDH1A1ESR1HSD17B10GAA | |
| SCHEMBL13474879 | 0.85 | TSHR (0.55) | TSHRALDH1A1ESR1HSD17B10GAA | |
| SCHEMBL19720352 | 0.84 | TSHR (0.68) | TSHRALDH1A1ESR1HSD17B10GAA | |
| SCHEMBL19720327 | 0.83 | TSHR (0.50) | TSHRALDH1A1ESR1HSD17B10GAA | |
| SCHEMBL19720379 | 0.82 | TSHR (0.49) | TSHRALDH1A1ESR1HSD17B10GAA | |
| SCHEMBL19884516 | 0.82 | TSHR (0.49) | TSHRALDH1A1ESR1HSD17B10GAA |
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-2855630-B1 | LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY | MERCK PATENT GMBH (DE) | 2017-12-20 | — | — | EP | disclosed |