Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 7/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.61 |
| ▸ | ESR1 | P03372 | 4/20 | 0.61 |
| ▸ | HSD17B1 | P14061 | 8/20 | 0.49 |
| ▸ | HSD17B2 | P37059 | 8/20 | 0.49 |
| ▸ | SNCA | P37840 | 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 | |
|---|---|---|---|---|
| SCHEMBL26500046 | 0.82 | HSD17B1 (0.45) | APPESR2ESR1HSD17B1HSD17B2 | |
| SCHEMBL11887463 | 0.82 | HSD17B1 (0.38) | APPESR2ESR1HSD17B1HSD17B2 | |
| SCHEMBL4928563 | 0.82 | APP (0.41) | APPESR2ESR1HSD17B1HSD17B2 | |
| SCHEMBL14515076 | 0.81 | HSD17B1 (0.44) | APPESR2ESR1HSD17B1HSD17B2 | |
| SCHEMBL14416272 | 0.81 | ESR1 (0.48) | APPESR2ESR1 | |
| SCHEMBL26500109 | 0.80 | PRF1 (0.43) | APPESR2ESR1HSD17B1HSD17B2 | |
| SCHEMBL12331374 | 0.79 | NQO2 (0.44) | APPESR2ESR1HSD17B1HSD17B2 | |
| SCHEMBL25070495 | 0.78 | APP (0.56) | APPESR2ESR1HSD17B1HSD17B2 | |
| SCHEMBL14515083 | 0.78 | NPC1 (0.38) | APPESR2ESR1 | |
| SCHEMBL26501602 | 0.78 | KIF11 (0.39) | APPESR2ESR1HSD17B1HSD17B2 |
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-3623451-A1 | COMPOUND | Merck Patent GmbH (DE) | 2020-03-18 | — | — | EP | disclosed |