Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 9/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 9/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | DGAT1 | O75907 | 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 | |
|---|---|---|---|---|
| SCHEMBL13390352 | 0.92 | DGAT1 (0.32) | DGAT1 | |
| SCHEMBL4553681 | 0.90 | KEAP1 (0.34) | ALDH1A1KEAP1NFE2L2DGAT1 | |
| SCHEMBL3303955 | 0.86 | ALDH1A1 (0.33) | ALDH1A1KEAP1NFE2L2 | |
| SCHEMBL3303950 | 0.86 | ALDH1A1 (0.33) | ALDH1A1KEAP1NFE2L2 | |
| SCHEMBL3325950 | 0.86 | ALDH1A1 (0.33) | ALDH1A1KEAP1NFE2L2 | |
| SCHEMBL3300839 | 0.86 | KEAP1 (0.35) | ALDH1A1KEAP1NFE2L2 | |
| SCHEMBL3299910 | 0.85 | DGAT1 (0.31) | DGAT1 | |
| SCHEMBL13390762 | 0.82 | DGAT1 (0.33) | DGAT1 | |
| SCHEMBL4440902 | 0.82 | KEAP1 (0.43) | KEAP1NFE2L2 | |
| SCHEMBL3297170 | 0.81 | KEAP1 (0.36) | KEAP1NFE2L2 |
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-2121600-B1 | SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS | BOEHRINGER INGELHEIM INT (DE) | 2012-07-18 | — | — | EP | disclosed |