Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 7/20 | 0.40 |
| ▸ | IL1B | P01584 | 2/20 | 0.39 |
| ▸ | MME | P08473 | 1/20 | 0.34 |
| ▸ | ACE | P12821 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 10/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | CASP6 | P55212 | 1/20 | 0.33 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6670787 | 0.91 | CASP1 (0.36) | CASP1IL1BMMEACELCK | |
| SCHEMBL6626820 | 0.91 | CASP1 (0.38) | CASP1IL1BMMEACELCK | |
| SCHEMBL6626823 | 0.91 | CASP1 (0.38) | CASP1IL1BMMEACELCK | |
| SCHEMBL6629028 | 0.91 | CASP1 (0.40) | CASP1IL1BMMEACELCK | |
| SCHEMBL6629031 | 0.91 | CASP1 (0.40) | CASP1IL1BMMEACELCK | |
| SCHEMBL6627405 | 0.88 | CASP1 (0.44) | CASP1IL1BMMEACELCK | |
| SCHEMBL6626880 | 0.88 | CASP1 (0.38) | CASP1IL1BMMEACELCK | |
| SCHEMBL7089222 | 0.85 | CASP1 (0.35) | CASP1IL1BMMEACELCK | |
| SCHEMBL6626824 | 0.84 | CASP1 (0.38) | CASP1IL1BMMEACELCK | |
| SCHEMBL6631460 | 0.82 | CASP1 (0.48) | CASP1IL1BMMEACELCK |
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-1246824-B1 | CARBOXAMIDE DIAZEPIN DERIVATIVES, PREPARATION METHOD, USE AS MEDICINES, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF | AVENTIS PHARMA SA (FR) | 2004-06-09 | — | — | EP | claimed |
| EP-1246824-B1 | CARBOXAMIDE DIAZEPIN DERIVATIVES, PREPARATION METHOD, USE AS MEDICINES, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF | AVENTIS PHARMA SA (FR) | 2004-06-09 | — | — | EP | disclosed |