Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | MAP3K5 | Q99683 | 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 | 0.92 | ESR2 (0.46) | ESR2ESR1MAP3K5 | |
| SCHEMBL20806237 | 0.90 | ESR2 (0.45) | ESR2ESR1MAP3K5 | |
| SCHEMBL21134134 | 0.84 | ESR1 (0.40) | ESR2ESR1MAP3K5 | |
| SCHEMBL21935552 | 0.84 | ESR1 (0.61) | ESR2ESR1 | |
| SCHEMBL22299388 | 0.83 | ESR1 (0.35) | ESR2ESR1 | |
| SCHEMBL19119566 | 0.83 | ESR1 (0.40) | ESR2ESR1MAP3K5 | |
| SCHEMBL18464805 | 0.83 | ESR1 (0.40) | ESR2ESR1MAP3K5 | |
| SCHEMBL25070528 | 0.82 | ESR1 (0.39) | ESR2ESR1MAP3K5 | |
| SCHEMBL18464327 | 0.82 | ESR1 (0.39) | ESR2ESR1MAP3K5 | |
| SCHEMBL20806070 | 0.80 | ESR1 (0.37) | ESR2ESR1MAP3K5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10260001-B2 | Liquid crystal material | MERCK PATENT GMBH (DE) | 2019-04-16 | — | — | US | disclosed |
| US-20170029702-A1 | LIQUID CRYSTAL MATERIAL | MERCK PATENT GMBH (DE) | 2017-02-02 | — | — | US | disclosed |