Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 17/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 17/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9701097 | 0.86 | SIGMAR1 (0.34) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9701099 | 0.85 | PTAFR (0.34) | — | |
| SCHEMBL9700197 | 0.84 | MAOB (0.32) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9701435 | 0.83 | ALDH1A1 (0.31) | — | |
| SCHEMBL9702149 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL9702700 | 0.73 | SIGMAR1 (0.33) | — | |
| SCHEMBL9701430 | 0.73 | CA1 (0.33) | — | |
| SCHEMBL7896255 | 0.70 | SIGMAR1 (0.36) | — | |
| SCHEMBL7905465 | 0.68 | SIGMAR1 (0.32) | — | |
| SCHEMBL7903496 | 0.68 | SIGMAR1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992013860-A1 | NEW 4,5,6,7-TETRAHYDRO-IMIDAZO-[4,5,lJK][1,4]-BENZODIAZEPINE-2-(1H)-THIONES, A METHOD OF PREPARING THEM AS WELL AS DRUGS CONTAINING THEM, AND INTERMEDIATES FOR THE PREPARATION OF THESE COMPOUNDS | BOEHRINGER MANNHEIM GMBH (DE) | 1992-08-20 | — | — | WO | disclosed |