Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9702149 | 0.91 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL9701435 | 0.86 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL9701097 | 0.83 | SIGMAR1 (0.34) | SIGMAR1KMT2AALDH1A1 | |
| SCHEMBL9701174 | 0.73 | SLC6A2 (0.36) | — | |
| SCHEMBL7896255 | 0.73 | SIGMAR1 (0.36) | SIGMAR1 | |
| SCHEMBL7484841 | 0.72 | MAPT (0.38) | SIGMAR1KMT2A | |
| SCHEMBL9701099 | 0.72 | PTAFR (0.34) | ALDH1A1 | |
| SCHEMBL9701190 | 0.68 | SIGMAR1 (0.33) | SIGMAR1 | |
| SCHEMBL9529927 | 0.68 | PRCP (0.40) | SIGMAR1 | |
| SCHEMBL32677173 | 0.67 | SIGMAR1 (0.43) | SIGMAR1ALDH1A1 |
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 |