Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | REN | P00797 | 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 | |
|---|---|---|---|---|
| SCHEMBL27557063 | 1.00 | NR1H2 (0.36) | NR1H2LMNAMAPK1HTTREN | |
| SCHEMBL27593040 | 0.90 | NR1H2 (0.37) | NR1H2LMNA | |
| SCHEMBL27593039 | 0.90 | NR1H2 (0.37) | NR1H2LMNA | |
| SCHEMBL27791275 | 0.87 | ITGB3 (0.38) | — | |
| SCHEMBL27593151 | 0.81 | NR1H2 (0.38) | NR1H2 | |
| SCHEMBL27593149 | 0.81 | NR1H2 (0.38) | NR1H2 | |
| SCHEMBL28794950 | 0.81 | NR1H2 (0.38) | NR1H2 | |
| SCHEMBL27593233 | 0.77 | LMNA (0.30) | LMNA | |
| SCHEMBL27593048 | 0.77 | LMNA (0.40) | LMNA | |
| SCHEMBL27896511 | 0.77 | HTR4 (0.36) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100503560-C | Substituted cyclohexane derivatives | HOFFMANN LA ROCHE (CH) | 2009-06-24 | — | — | CN | disclosed |
| CN-1993117-A | Hydroxyalkyl amide compounds | HOFFMANN LA ROCHE (CH) | 2007-07-04 | — | — | CN | disclosed |
| CN-1296357-C | Heteroaryl-substituted aminocyclohexane derivatives | HOFFMANN LA ROCHE (CH) | 2007-01-24 | — | — | CN | disclosed |
| CN-1610669-A | Heteroaryl-substituted aminocyclohexane derivatives | HOFFMANN LA ROCHE (CH) | 2005-04-27 | — | — | CN | disclosed |
| CN-1604890-A | Substituted cyclohexane derivatives | HOFFMANN LA ROCHE (CH) | 2005-04-06 | — | — | CN | disclosed |