Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAM17 | P78536 | 1/20 | 0.35 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.34 |
| ▸ | RRM1 | P23921 | 2/20 | 0.31 |
| ▸ | RRM2 | P31350 | 2/20 | 0.31 |
| ▸ | RRM2B | Q7LG56 | 2/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6558839 | 0.92 | PSENEN (0.36) | PSENENCASP1BACE1 | |
| SCHEMBL6558461 | 0.92 | RRM1 (0.33) | ADAM17RRM1RRM2RRM2B | |
| SCHEMBL6558475 | 0.92 | PSENEN (0.32) | PSENENCASP1BACE1 | |
| SCHEMBL6558973 | 0.89 | PSENEN (0.36) | PSENENCASP1BACE1 | |
| SCHEMBL6558456 | 0.89 | PSENEN (0.37) | PSENENCASP1BACE1 | |
| SCHEMBL6558829 | 0.84 | MMP1 (0.32) | ADAM17RRM1RRM2RRM2B | |
| SCHEMBL6558487 | 0.83 | PDF (0.32) | ADAM17RRM1RRM2RRM2B | |
| SCHEMBL6558489 | 0.81 | CASP1 (0.36) | RRM1RRM2RRM2BCASP1 | |
| SCHEMBL6558467 | 0.80 | MEN1 (0.31) | — | |
| SCHEMBL8001329 | 0.80 | CAPN1 (0.35) | CASP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0948523-B1 | PEPTIDOMIMETIC INHIBITORS OF THE HUMAN CYTOMEGALOVIRUS PROTEASE | BOEHRINGER INGELHEIM CA LTD (CA) | 2004-03-17 | — | — | EP | claimed |
| US-6291640-B1 | OLIGOPEPTIDES; SOLID PHASE SYNTHESIS | BOEHRINGER INGELHEIM LTD. (CA) | 2001-09-18 | — | — | US | claimed |
| EP-0948523-B1 | PEPTIDOMIMETIC INHIBITORS OF THE HUMAN CYTOMEGALOVIRUS PROTEASE | BOEHRINGER INGELHEIM CA LTD (CA) | 2004-03-17 | — | — | EP | disclosed |
| US-6291640-B1 | OLIGOPEPTIDES; SOLID PHASE SYNTHESIS | BOEHRINGER INGELHEIM LTD. (CA) | 2001-09-18 | — | — | US | disclosed |