Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 12/20 | 0.41 |
| ▸ | CA1 | P00915 | 9/20 | 0.41 |
| ▸ | CA9 | Q16790 | 7/20 | 0.41 |
| ▸ | CA12 | O43570 | 5/20 | 0.40 |
| ▸ | CA6 | P23280 | 3/20 | 0.40 |
| ▸ | CA7 | P43166 | 3/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | CA5A | P35218 | 2/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | PTGES2 | Q9H7Z7 | 3/20 | 0.38 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.36 |
| ▸ | FEN1 | P39748 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4664484 | 0.84 | LMNA (0.46) | CA2CA1CA9CA12CA6 | |
| SCHEMBL2397343 | 0.76 | CA2 (0.45) | CA2CA1CA9CA12CA6 | |
| SCHEMBL4663042 | 0.75 | KCNA5 (0.43) | CA2CA1CA9CA12CA6 | |
| SCHEMBL4661756 | 0.74 | CA2 (0.48) | CA2CA1CA9CA12 | |
| SCHEMBL4662992 | 0.74 | PTGES2 (0.54) | CA2CA1CA9CA12CA6 | |
| SCHEMBL4661657 | 0.74 | CA2 (0.44) | CA2CA1CA9CA12CA6 | |
| SCHEMBL407413 | 0.73 | CA2 (0.50) | CA2CA1CA9CA12CA6 | |
| SCHEMBL30988956 | 0.73 | CA2 (0.50) | CA2CA1CA9CA12CA6 | |
| SCHEMBL3651546 | 0.72 | CA2 (0.50) | CA2CA1CA9CA12CA6 | |
| SCHEMBL31471001 | 0.72 | CA2 (0.50) | CA2CA1CA9CA12CA6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1311475-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-05-21 | — | — | EP | disclosed |
| WO-2002014267-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-02-21 | — | — | WO | disclosed |