Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL597746 | 0.97 | CYP2A6 (0.39) | CYP2A6ALOX12ALDH1A1TSHRHSD17B10 | |
| SCHEMBL35 | 0.97 | CYP2A6 (0.39) | CYP2A6ALOX12ALDH1A1TSHRHSD17B10 | |
| SCHEMBL20873650 | 0.94 | CYP2A6 (0.37) | CYP2A6ALOX12ALDH1A1TSHRHSD17B10 | |
| SCHEMBL29094877 | 0.94 | CYP2A6 (0.37) | CYP2A6ALOX12ALDH1A1TSHRHSD17B10 | |
| SCHEMBL20526418 | 0.94 | CYP2A6 (0.37) | CYP2A6ALOX12ALDH1A1TSHRHSD17B10 | |
| SCHEMBL6409528 | 0.94 | CYP2A6 (0.37) | CYP2A6ALOX12ALDH1A1TSHRHSD17B10 | |
| SCHEMBL15969806 | 0.94 | CYP2A6 (0.37) | CYP2A6ALOX12ALDH1A1TSHRHSD17B10 | |
| Biphenyl SCHEMBL28417976 | 0.93 | ALDH1A1 (0.43) | CYP2A6ALOX12ALDH1A1HSD17B10TDP1 | |
| SCHEMBL21253156 | 0.92 | CYP2A6 (0.35) | CYP2A6ALOX12 | |
| SCHEMBL28834554 | 0.92 | CYP2A6 (0.35) | CYP2A6ALOX12 |
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-103874681-B | Fungicidal 4-substituted-3-{phenyl[(heterocyclylmethoxy)imino]methyl}-1,2,4-oxadizol-5(4H)-one derivatives | 拜耳知识产权有限责任公司 | 2017-01-18 | — | — | CN | claimed |