Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19720348 | 0.92 | GAA (0.46) | GAAHTTALDH1A1ESR1HSD17B10 | |
| SCHEMBL19884620 | 0.81 | GAA (0.41) | GAAHTTTSHRKMT2AL3MBTL1 | |
| SCHEMBL18522680 | 0.79 | GAA (0.42) | GAAHTTALDH1A1ESR1HSD17B10 | |
| SCHEMBL10222459 | 0.78 | GAA (0.46) | GAAHTTALDH1A1ESR1HSD17B10 | |
| SCHEMBL26083013 | 0.77 | GAA (0.44) | GAAHTTALDH1A1ESR1HSD17B10 | |
| SCHEMBL20194436 | 0.77 | GAA (0.44) | GAAHTTALDH1A1ESR1HSD17B10 | |
| SCHEMBL19884590 | 0.76 | GAA (0.54) | GAAHTTALDH1A1ESR1HSD17B10 | |
| SCHEMBL26083011 | 0.76 | GAA (0.43) | GAAHTTALDH1A1ESR1HSD17B10 | |
| SCHEMBL4734071 | 0.74 | ALDH1A1 (0.50) | GAAHTTALDH1A1ESR1HSD17B10 | |
| SCHEMBL30022335 | 0.74 | GAA (0.48) | GAAHTTALDH1A1ESR1HSD17B10 |
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-2514800-B2 | Compounds and liquid crystalline medium | MERCK PATENT GMBH (DE) | 2018-03-07 | — | — | EP | disclosed |