Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKAR | P32238 | 8/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | RPA1 | P27694 | 1/20 | 0.45 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.44 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27914757 | 0.88 | PTGS2 (0.49) | CCKARPTGS1PTGS2KCNJ6KCNJ3 | |
| SCHEMBL3096791 | 0.86 | MEN1 (0.48) | CCKARPTGS1PTGS2 | |
| SCHEMBL14504449 | 0.86 | MGLL (0.52) | PTGS1PTGS2RPA1KCNJ6KCNJ3 | |
| SCHEMBL14714593 | 0.85 | CCKAR (0.48) | CCKARPTGS1PTGS2RPA1 | |
| SCHEMBL3104741 | 0.84 | CCKAR (0.47) | CCKARPTGS2 | |
| SCHEMBL14714376 | 0.83 | CCKAR (0.48) | CCKARPTGS1PTGS2 | |
| SCHEMBL13993264 | 0.82 | PTGS2 (0.46) | CCKARPTGS1PTGS2 | |
| SCHEMBL13157959 | 0.82 | CCKAR (0.48) | CCKAR | |
| SCHEMBL13157986 | 0.82 | CCKAR (0.48) | CCKAR | |
| SCHEMBL14504928 | 0.82 | PTGS2 (0.47) | CCKARPTGS1PTGS2RPA1KCNJ6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010050577-A1 | CYCLOHEXANE DERIVATIVE AND PHARMACEUTICAL USE THEREOF | 東レ株式会社 (JP) | 2010-05-06 | — | — | WO | disclosed |