Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 7/20 | 0.51 |
| ▸ | IL1B | P01584 | 2/20 | 0.47 |
| ▸ | LCK | P06239 | 12/20 | 0.40 |
| ▸ | MME | P08473 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6628994 | 0.88 | CASP1 (0.50) | CASP1IL1BLCK | |
| SCHEMBL6626534 | 0.88 | CASP1 (0.50) | CASP1IL1BLCK | |
| SCHEMBL6628733 | 0.87 | CASP1 (0.50) | CASP1IL1BLCKMMEACE | |
| SCHEMBL6628735 | 0.87 | CASP1 (0.50) | CASP1IL1BLCKMMEACE | |
| SCHEMBL6628996 | 0.86 | CASP1 (0.45) | CASP1IL1BLCK | |
| SCHEMBL6627309 | 0.85 | CASP1 (0.48) | CASP1IL1BLCKMMEACE | |
| SCHEMBL6627548 | 0.85 | CASP1 (0.45) | CASP1IL1BLCKMMEACE | |
| SCHEMBL646652 | 0.81 | CASP1 (0.64) | CASP1IL1BLCKMMEACE | |
| SCHEMBL10247734 | 0.81 | CASP1 (0.64) | CASP1IL1BLCKMMEACE | |
| SCHEMBL645039 | 0.81 | CASP1 (0.64) | CASP1IL1BLCKMMEACE |
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 |
|---|---|---|---|---|---|---|---|
| EP-1246824-B1 | CARBOXAMIDE DIAZEPIN DERIVATIVES, PREPARATION METHOD, USE AS MEDICINES, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF | AVENTIS PHARMA SA (FR) | 2004-06-09 | — | — | EP | claimed |