Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PTGES | O14684 | 1/20 | 0.31 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.31 |
| ▸ | TNKS | O95271 | 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 | |
|---|---|---|---|---|
| SCHEMBL91706 | 0.91 | ERN1 (0.32) | ESR1ESR2ERN1 | |
| SCHEMBL91718 | 0.88 | ESR1 (0.37) | ESR1ESR2ERN1PTGESTNKS2 | |
| SCHEMBL14075290 | 0.84 | ESR1 (0.38) | ESR1ESR2TNKS2 | |
| SCHEMBL91728 | 0.80 | — | — | |
| SCHEMBL91742 | 0.79 | ESR1 (0.31) | ESR1ESR2 | |
| SCHEMBL91776 | 0.78 | — | — | |
| SCHEMBL91719 | 0.78 | CYP1A2 (0.33) | ESR1ESR2DHODHMEN1KMT2A | |
| SCHEMBL91766 | 0.78 | — | — | |
| SCHEMBL91754 | 0.77 | MAPT (0.34) | ESR1ESR2KDM4EMEN1KMT2A | |
| SCHEMBL19703044 | 0.77 | HSD17B1 (0.38) | ESR1ESR2ERN1DHODHTNKS2 |
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-8129002-B2 | Compounds for use in liquid crystal media | MERCK PATENT GMBH (DE) | 2012-03-06 | — | — | US | disclosed |
| US-7419706-B2 | Liquid crystalline medium | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2008-09-02 | — | — | US | disclosed |