Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | ABL1 | P00519 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL91729 | 0.91 | ERN1 (0.32) | ESR1ESR2PTPN1ABL1 | |
| SCHEMBL91735 | 0.82 | — | — | |
| SCHEMBL17548018 | 0.80 | PTPN5 (0.34) | — | |
| SCHEMBL91724 | 0.79 | AR (0.37) | PTPN1 | |
| SCHEMBL91731 | 0.79 | — | — | |
| SCHEMBL91694 | 0.78 | ESR1 (0.43) | ESR1ESR2ABL1 | |
| SCHEMBL12829123 | 0.78 | TSHR (0.34) | — | |
| SCHEMBL91766 | 0.77 | — | — | |
| SCHEMBL91753 | 0.75 | — | — | |
| SCHEMBL17070828 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8129002-B2 | Compounds for use in liquid crystal media | MERCK PATENT GMBH (DE) | 2012-03-06 | — | — | US | disclosed |