Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.33 |
| ▸ | VDR | P11473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9701190 | 0.77 | SIGMAR1 (0.33) | — | |
| SCHEMBL9700201 | 0.66 | DRD1 (0.33) | — | |
| SCHEMBL3587267 | 0.62 | BRD4 (0.54) | KEAP1NFE2L2 | |
| SCHEMBL12714314 | 0.61 | PARP1 (0.50) | KEAP1NFE2L2TLR9VDR | |
| SCHEMBL7902262 | 0.60 | HTR1A (0.39) | — | |
| SCHEMBL7652793 | 0.60 | MAOA (0.37) | — | |
| SCHEMBL25080719 | 0.58 | NAMPT (0.57) | — | |
| SCHEMBL3596149 | 0.57 | PARP1 (0.49) | — | |
| SCHEMBL3593434 | 0.57 | PARP1 (0.47) | — | |
| SCHEMBL1119383 | 0.56 | CD44 (0.46) | — |
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 |