Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL21770810 | 0.89 | SLC6A2 (0.57) | SLC6A2CACNA2D1 | |
| SCHEMBL19564728 | 0.83 | CACNA2D1 (0.68) | SLC6A2CACNA2D1 | |
| SCHEMBL19564807 | 0.83 | SLC6A2 (0.70) | SLC6A2CACNA2D1 | |
| SCHEMBL19564818 | 0.82 | CACNA2D1 (0.68) | SLC6A2CACNA2D1 | |
| SCHEMBL19553454 | 0.81 | CACNA2D1 (0.67) | SLC6A2CACNA2D1 | |
| SCHEMBL19553375 | 0.81 | CACNA2D1 (0.86) | SLC6A2CACNA2D1 | |
| SCHEMBL21770804 | 0.77 | CACNA2D1 (0.47) | SLC6A2CACNA2D1 | |
| SCHEMBL19553287 | 0.76 | CACNA2D1 (0.76) | SLC6A2CACNA2D1 | |
| SCHEMBL19553850 | 0.76 | SLC6A2 (0.72) | SLC6A2CACNA2D1 | |
| SCHEMBL19553214 | 0.74 | CACNA2D1 (0.64) | SLC6A2CACNA2D1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3452475-B1 | TETRAHYDROPYRIMIDODIAZEPINE AND TETRAHYDROPYRIDODIAZEPINE COMPOUNDS FOR TREATING PAIN AND PAIN RELATED CONDITIONS | ESTEVE PHARMACEUTICALS SA (ES) | 2020-02-26 | — | — | EP | disclosed |
| WO-2017191304-A1 | TETRAHYDROPYRIMIDODIAZEPINE AND TETRAHYDROPYRIDODIAZEPINE COMPOUNDS FOR TREATING PAIN AND PAIN RELATED CONDITIONS | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2017-11-09 | — | — | WO | disclosed |