Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 4/20 | 0.45 |
| ▸ | ESR1 | P03372 | 4/20 | 0.45 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL19369162 | 0.98 | ESR2 (0.46) | ESR2ESR1MAP3K5HSD17B1HSD17B2 | |
| SCHEMBL21134134 | 0.93 | ESR1 (0.40) | ESR2ESR1MAP3K5GRM2 | |
| SCHEMBL21935552 | 0.90 | ESR1 (0.61) | ESR2ESR1HSD17B1HSD17B2 | |
| SCHEMBL18464807 | 0.90 | ESR2 (0.40) | ESR2ESR1MAP3K5 | |
| SCHEMBL19119566 | 0.89 | ESR1 (0.40) | ESR2ESR1MAP3K5HSD17B1HSD17B2 | |
| SCHEMBL18464805 | 0.89 | ESR1 (0.40) | ESR2ESR1MAP3K5HSD17B1HSD17B2 | |
| SCHEMBL25070528 | 0.88 | ESR1 (0.39) | ESR2ESR1MAP3K5 | |
| SCHEMBL20806066 | 0.88 | ESR1 (0.39) | ESR2ESR1MAP3K5 | |
| SCHEMBL18464327 | 0.88 | ESR1 (0.39) | ESR2ESR1MAP3K5GRM2 | |
| SCHEMBL20806070 | 0.86 | ESR1 (0.37) | ESR2ESR1MAP3K5GRM2 |
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-3004251-B1 | DEVICE FOR CONTROLLING THE PASSAGE OF ENERGY, CONTAINING A DICHROIC DYE COMPOUND | MERCK PATENT GMBH (DE) | 2019-03-13 | — | — | EP | disclosed |