Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LNPEP | Q9UIQ6 | 2/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL16349768 | 0.90 | LNPEP (0.33) | LNPEP | |
| SCHEMBL13684945 | 0.88 | CYP3A4 (0.35) | BACE1 | |
| SCHEMBL8290521 | 0.88 | CYP3A4 (0.35) | BACE1 | |
| SCHEMBL13684944 | 0.88 | CYP3A4 (0.35) | BACE1 | |
| SCHEMBL13685733 | 0.86 | ELANE (0.33) | ATMMEN1KMT2A | |
| SCHEMBL12606616 | 0.84 | BACE1 (0.40) | BACE1 | |
| SCHEMBL8291409 | 0.84 | BACE1 (0.40) | BACE1 | |
| SCHEMBL13685190 | 0.84 | BACE1 (0.40) | BACE1 | |
| SCHEMBL13684966 | 0.78 | CYP3A4 (0.36) | — | |
| SCHEMBL13685116 | 0.78 | CYP3A4 (0.36) | — |
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-2005030796-A1 | MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS NS3 SERINE PROTEASE | SCHERING CORPORATION (US) | 2005-04-07 | — | — | WO | disclosed |