Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 10/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 10/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PER2 | O15055 | 1/20 | 0.37 |
| ▸ | CRY1 | Q16526 | 1/20 | 0.37 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4427287 | 0.92 | KEAP1 (0.43) | TP53KEAP1NFE2L2ALDH1A1L3MBTL1 | |
| SCHEMBL2850695 | 0.92 | TP53 (0.44) | TP53KEAP1NFE2L2ALDH1A1L3MBTL1 | |
| SCHEMBL4438191 | 0.88 | KEAP1 (0.47) | TP53KEAP1NFE2L2PER2CRY1 | |
| SCHEMBL13389986 | 0.86 | PER2 (0.35) | TP53KEAP1NFE2L2ALDH1A1PER2 | |
| SCHEMBL7355234 | 0.81 | TP53 (0.52) | TP53KEAP1NFE2L2ALDH1A1L3MBTL1 | |
| SCHEMBL4433156 | 0.81 | KEAP1 (0.52) | TP53KEAP1NFE2L2PER2CRY1 | |
| SCHEMBL10317516 | 0.81 | KEAP1 (0.48) | TP53KEAP1NFE2L2ALDH1A1L3MBTL1 | |
| SCHEMBL13389979 | 0.78 | PER2 (0.38) | TP53KEAP1NFE2L2ALDH1A1PER2 | |
| SCHEMBL11948414 | 0.78 | HCRTR2 (0.44) | ALDH1A1PER2CRY1CRY2 | |
| SCHEMBL11948410 | 0.78 | PER2 (0.38) | TP53PER2CRY1CRY2AHR |
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 3 patents. 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 |
| EP-2121600-A2 | SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS | Boehringer Ingelheim International GmbH (DE) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008099000-A2 | SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-08-21 | — | — | WO | disclosed |