Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10166024 | 0.91 | CYP3A4 (0.33) | CYP3A4 | |
| SCHEMBL10166390 | 0.90 | MCL1 (0.33) | — | |
| SCHEMBL6124825 | 0.86 | MCL1 (0.32) | CYP3A4 | |
| SCHEMBL6124833 | 0.84 | — | — | |
| SCHEMBL13071919 | 0.84 | HDAC1 (0.33) | — | |
| SCHEMBL6124836 | 0.83 | — | — | |
| SCHEMBL6124752 | 0.83 | HDAC1 (0.36) | — | |
| SCHEMBL13071911 | 0.82 | HDAC1 (0.32) | — | |
| SCHEMBL12831634 | 0.81 | F2 (0.39) | — | |
| SCHEMBL12831730 | 0.80 | MCL1 (0.34) | CYP3A4 |
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-2012054874-A1 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2012-04-26 | — | — | WO | disclosed |