Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24004690 | 0.90 | CYP1A2 (0.36) | CYP1A2PPARG | |
| SCHEMBL3109163 | 0.90 | CYP1A2 (0.36) | CYP1A2PPARG | |
| SCHEMBL3104341 | 0.87 | CYP1A2 (0.51) | CYP1A2PPARG | |
| SCHEMBL24668316 | 0.76 | ATM (0.34) | CYP1A2 | |
| SCHEMBL24668274 | 0.76 | ATM (0.34) | CYP1A2 | |
| SCHEMBL9189791 | 0.75 | CYP1A2 (0.35) | CYP1A2CA1CA9 | |
| SCHEMBL27869531 | 0.72 | PPARG (0.54) | CYP1A2PPARG | |
| SCHEMBL6242463 | 0.71 | CYP1A2 (0.49) | CYP1A2CA1CA9PPARG | |
| SCHEMBL9193943 | 0.71 | CYP1A2 (0.41) | CYP1A2CA1CA9PPARG | |
| SCHEMBL9618293 | 0.70 | CYP1A2 (0.44) | CYP1A2PPARG |
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-0694615-A2 | Process for the preparation of gamma-nonalactones in native form | PERNOD-RICARD (FR) | 1996-01-31 | — | — | EP | claimed |
| EP-0694615-A2 | Process for the preparation of gamma-nonalactones in native form | PERNOD-RICARD (FR) | 1996-01-31 | — | — | EP | disclosed |