Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 2/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
| ▸ | KIF11 | P52732 | 16/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
| ▸ | TPX2 | Q9ULW0 | 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 | |
|---|---|---|---|---|
| SCHEMBL14749464 | 0.82 | ALOX5AP (0.38) | CYP11B1CYP11B2KIF11 | |
| SCHEMBL13863896 | 0.81 | ANPEP (0.38) | — | |
| SCHEMBL91919 | 0.81 | DAO (0.36) | — | |
| SCHEMBL16707064 | 0.78 | DAO (0.34) | — | |
| SCHEMBL13808385 | 0.78 | NPC1 (0.35) | CYP11B1CYP11B2 | |
| SCHEMBL7913380 | 0.75 | KIF11 (0.66) | KIF11AR | |
| SCHEMBL13002538 | 0.75 | CYP11B1 (0.46) | CYP11B1CYP11B2KIF11AR | |
| SCHEMBL13863713 | 0.75 | CYP11B1 (0.46) | CYP11B1CYP11B2KIF11AR | |
| SCHEMBL19801831 | 0.74 | CYP11B1 (0.52) | CYP11B1CYP11B2PGRAR | |
| SCHEMBL7732093 | 0.71 | PRMT6 (0.36) | CYP11B1CYP11B2KIF11AURKATPX2 |
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-7531106-B2 | Mesogenic compounds, medium for electro-optical displays and electro-optical display | MERCK PATENT GMBH (DE) | 2009-05-12 | — | — | US | disclosed |