Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL29112049 | 0.70 | UGT2B7 (0.31) | CYP1A2 | |
| SCHEMBL11447770 | 0.69 | CYP1A2 (0.38) | CYP1A2 | |
| SCHEMBL11356731 | 0.69 | CYP1A2 (0.38) | CYP1A2 | |
| SCHEMBL11356723 | 0.69 | CYP1A2 (0.38) | CYP1A2 | |
| SCHEMBL28994668 | 0.66 | — | — | |
| SCHEMBL29035731 | 0.66 | HIF1A (0.35) | CYP1A2 | |
| SCHEMBL29113888 | 0.66 | HIF1A (0.35) | CYP1A2 | |
| SCHEMBL4495310 | 0.63 | CYP1A2 (0.44) | CYP1A2 | |
| SCHEMBL29173984 | 0.62 | — | — | |
| SCHEMBL29009400 | 0.62 | CYP1A2 (0.36) | CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4187863-A | Cycloaliphatic unsaturated ketones as odor and taste modifying agents in tobacco products | FIRMENICH SA (CH) | 1980-02-12 | — | — | US | disclosed |