Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 5/20 | 0.35 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.33 |
| ▸ | RAC1 | P63000 | 1/20 | 0.30 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.30 |
| ▸ | PDK2 | Q15119 | 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 | |
|---|---|---|---|---|
| SCHEMBL91692 | 0.92 | AR (0.32) | ARRAPGEF4 | |
| SCHEMBL91801 | 0.86 | AR (0.35) | AR | |
| SCHEMBL91679 | 0.83 | AR (0.38) | ARRAPGEF4PDK2 | |
| SCHEMBL91676 | 0.82 | LMNA (0.34) | AR | |
| SCHEMBL91665 | 0.80 | RAPGEF4 (0.31) | RAPGEF4 | |
| SCHEMBL91659 | 0.78 | GABRA1 (0.30) | RAPGEF4 | |
| SCHEMBL91680 | 0.76 | — | — | |
| SCHEMBL91784 | 0.72 | — | — | |
| SCHEMBL29305770 | 0.71 | — | — | |
| SCHEMBL660089 | 0.70 | GABRA1 (0.39) | RAPGEF4 |
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 |