Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.30 |
| ▸ | NFE2L2 | Q16236 | 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 | |
|---|---|---|---|---|
| SCHEMBL29853848 | 0.94 | KEAP1 (0.33) | ALDH1A1KEAP1NFE2L2 | |
| SCHEMBL29023921 | 0.92 | KEAP1 (0.30) | KEAP1NFE2L2 | |
| SCHEMBL16289800 | 0.86 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL34699 | 0.85 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL45977 | 0.84 | — | — | |
| SCHEMBL3462014 | 0.81 | CYP1A2 (0.45) | ALDH1A1KEAP1NFE2L2 | |
| SCHEMBL20798645 | 0.81 | CYP1A2 (0.45) | ALDH1A1KEAP1NFE2L2 | |
| SCHEMBL19853228 | 0.81 | CYP1A2 (0.45) | ALDH1A1KEAP1NFE2L2 | |
| SCHEMBL19969578 | 0.81 | CYP1A2 (0.45) | ALDH1A1KEAP1NFE2L2 | |
| SCHEMBL19849589 | 0.81 | CYP1A2 (0.45) | ALDH1A1KEAP1NFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2601317-B1 | COMPOSITIONS COMPRISING AT LEAST ONE COMPOUND CONTAINING A CARBAMOYL SULFONATE GROUP AND USE OF THE SAME AS TANNING AGENTS | LANXESS DEUTSCHLAND GMBH (DE) | 2014-12-17 | — | — | EP | claimed |