Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15469116 | 0.85 | CA12 (0.36) | CA12CA1CA2CA9 | |
| SCHEMBL13780583 | 0.75 | — | — | |
| SCHEMBL18215559 | 0.74 | LMNA (0.35) | — | |
| SCHEMBL28689646 | 0.69 | ALDH1A1 (0.37) | CA1 | |
| SCHEMBL28370546 | 0.65 | LMNA (0.38) | — | |
| SCHEMBL23857924 | 0.65 | — | — | |
| SCHEMBL28028362 | 0.65 | — | — | |
| SCHEMBL15039785 | 0.65 | — | — | |
| SCHEMBL14697416 | 0.65 | — | — | |
| SCHEMBL27595795 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1100052-C | 2-cyclohexane-1, 3-dione benzoyl derivatives | BASF AG (DE) | 2003-01-29 | — | — | CN | disclosed |