Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL7706305 | 0.96 | CYP1A1 (0.31) | CYP1A1CYP1B1ALDH1A1GAA | |
| SCHEMBL7706291 | 0.95 | CYP1A1 (0.31) | CYP1A1CYP1B1ALDH1A1 | |
| SCHEMBL7701379 | 0.95 | CYP1A1 (0.31) | CYP1A1CYP1B1ALDH1A1 | |
| SCHEMBL7709314 | 0.95 | CYP1A1 (0.31) | CYP1A1CYP1B1ALDH1A1 | |
| SCHEMBL678693 | 0.91 | ALDH1A1 (0.40) | ALDH1A1GAA | |
| SCHEMBL6829113 | 0.81 | CYP4F2 (0.41) | — | |
| SCHEMBL6048003 | 0.81 | MEN1 (0.37) | — | |
| SCHEMBL1960824 | 0.79 | GAA (0.33) | GAA | |
| SCHEMBL2765950 | 0.79 | — | — | |
| SCHEMBL1695953 | 0.76 | TSHR (0.34) | CYP1A1CYP1B1ALDH1A1 |
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-6355702-B1 | HEAT DECOMPOSITION OF ACRYLIC RESIN; CURING; CROSSLINKED NETWORK | CORNELL RESEARCH FOUNDATION, INC. | 2002-03-12 | — | — | US | disclosed |