Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 2/20 | 0.43 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.43 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL745424 | 0.91 | TBK1 (0.39) | TBK1IKBKESUV39H2 | |
| SCHEMBL14117573 | 0.91 | TBK1 (0.39) | TBK1IKBKESUV39H2 | |
| SCHEMBL2384758 | 0.91 | HTR2C (0.40) | TBK1IKBKESUV39H2 | |
| SCHEMBL13832397 | 0.91 | SUV39H2 (0.41) | TBK1IKBKESUV39H2 | |
| SCHEMBL12208682 | 0.90 | IKBKE (0.41) | TBK1IKBKESUV39H2 | |
| SCHEMBL633835 | 0.89 | TBK1 (0.38) | TBK1IKBKESUV39H2 | |
| SCHEMBL629922 | 0.87 | TBK1 (0.39) | TBK1IKBKESUV39H2 | |
| SCHEMBL22816649 | 0.87 | IKBKE (0.38) | TBK1IKBKESUV39H2 | |
| SCHEMBL10132000 | 0.87 | TBK1 (0.38) | TBK1IKBKESUV39H2 | |
| SCHEMBL13747318 | 0.87 | TBK1 (0.38) | TBK1IKBKESUV39H2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1447435-B1 | 1,4-Di-(trans-4-Cyclohexyl)benzene derivatives and their use in liquid crystal media and liquid crystal devices | MERCK PATENT GMBH (DE) | 2007-10-24 | — | — | EP | disclosed |