Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.56 |
| ▸ | CASP1 | P29466 | 1/20 | 0.56 |
| ▸ | CASP4 | P49662 | 1/20 | 0.56 |
| ▸ | CASP7 | P55210 | 1/20 | 0.56 |
| ▸ | CASP9 | P55211 | 1/20 | 0.56 |
| ▸ | CASP6 | P55212 | 1/20 | 0.56 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.52 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | DRD1 | P21728 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9101244 | 0.81 | CASP1 (0.45) | CASP3CASP1CASP4CASP7CASP9 | |
| SCHEMBL9004267 | 0.79 | NR1H2 (0.47) | CASP1CASP7NR1H2NR1H3CA1 | |
| SCHEMBL2113066 | 0.76 | ALDH1A1 (0.56) | CASP3ALDH1A1MAPTLMNACAPN9 | |
| SCHEMBL29214096 | 0.76 | CASP1 (0.48) | CASP3CASP1CASP4CASP7CASP9 | |
| SCHEMBL30867079 | 0.76 | CASP1 (0.48) | CASP3CASP1CASP4CASP7CASP9 | |
| SCHEMBL13402242 | 0.74 | MAPT (0.57) | CASP3CASP1CASP4CASP7CASP9 | |
| SCHEMBL13437129 | 0.74 | MAPT (0.57) | CASP3ALDH1A1MAOBMAOAMAPT | |
| SCHEMBL9807143 | 0.74 | ACHE (0.41) | CASP3CASP1CASP4CASP7CASP9 | |
| SCHEMBL30232255 | 0.72 | CASP3 (1.00) | CASP3CASP1CASP4CASP7CASP9 | |
| SCHEMBL3594484 | 0.72 | CASP3 (1.00) | CASP3CASP1CASP4CASP7CASP9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5571806-A | Dibenz[b,f][1,4]oxazepin(and thiazepin)-11(10H)-ones and-thiones and their use in the prevention or treatment of HIV infection | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 1996-11-05 | — | — | US | disclosed |
| EP-0419861-B1 | Use of dibenz[b,f][1,4]oxazepin (and thiazepin)-11(10H)-ones and -thiones in the preparation of a pharmaceutical composition for the prevention or treatment of aids | BOEHRINGER INGELHEIM PHARMA (US) | 1995-11-02 | — | — | EP | disclosed |
| EP-0419861-A2 | Use of dibenz[b,f][1,4]oxazepin (and thiazepin)-11(10H)-ones and -thiones in the preparation of a pharmaceutical composition for the prevention or treatment of aids | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 1991-04-03 | — | — | EP | disclosed |