Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 16/20 | 0.45 |
| ▸ | CASP7 | P55210 | 16/20 | 0.45 |
| ▸ | CASP9 | P55211 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27722084 | 1.00 | CASP3 (0.45) | CASP3CASP7CASP9KCNH2HRH3 | |
| SCHEMBL18693375 | 1.00 | CASP3 (0.45) | CASP3CASP7CASP9KCNH2HRH3 | |
| SCHEMBL29021682 | 0.89 | CASP3 (0.36) | CASP3CASP7CASP9KCNH2HRH3 | |
| SCHEMBL31295618 | 0.84 | CASP3 (0.46) | CASP3CASP7CASP9KCNH2HRH3 | |
| SCHEMBL13269872 | 0.84 | CASP3 (0.46) | CASP3CASP7CASP9KCNH2HRH3 | |
| SCHEMBL13269871 | 0.82 | CASP3 (0.45) | CASP3CASP7CASP9KCNH2HRH3 | |
| SCHEMBL13269870 | 0.82 | CASP3 (0.45) | CASP3CASP7CASP9KCNH2HRH3 | |
| SCHEMBL15927312 | 0.79 | PSEN1 (0.46) | — | |
| SCHEMBL5112047 | 0.79 | CASP7 (0.44) | CASP3CASP7CASP9KCNH2HRH3 | |
| SCHEMBL5112038 | 0.79 | CASP7 (0.44) | CASP3CASP7CASP9KCNH2HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| US-7829665-B2 | Macrocyclic inhibitors of hepatitis C virus replication | INTERMUNE, INC. (US) | 2010-11-09 | — | — | US | disclosed |