Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 9/20 | 0.45 |
| ▸ | CTSD | P07339 | 4/20 | 0.45 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.45 |
| ▸ | CTSE | P14091 | 1/20 | 0.43 |
| ▸ | PGC | P20142 | 1/20 | 0.43 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7423727 | 1.00 | BACE1 (0.45) | BACE1CTSDBACE2CTSEPGC | |
| SCHEMBL4875199 | 1.00 | BACE1 (0.45) | BACE1CTSDBACE2CTSEPGC | |
| SCHEMBL4875192 | 1.00 | BACE1 (0.45) | BACE1CTSDBACE2CTSEPGC | |
| SCHEMBL7359857 | 0.99 | BACE1 (0.43) | BACE1CTSDBACE2SLC6A11 | |
| SCHEMBL7248538 | 0.99 | BACE1 (0.43) | BACE1CTSDBACE2SLC6A11 | |
| SCHEMBL7248541 | 0.99 | BACE1 (0.43) | BACE1CTSDBACE2SLC6A11 | |
| SCHEMBL4873517 | 0.89 | CTSD (0.43) | BACE1CTSDBACE2SLC6A11 | |
| SCHEMBL4873509 | 0.89 | CTSD (0.43) | BACE1CTSDBACE2SLC6A11 | |
| SCHEMBL14066009 | 0.86 | KLK5 (0.55) | — | |
| SCHEMBL4865843 | 0.85 | KLK5 (0.56) | — |
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-1086076-A1 | SULFONAMIDE INHIBITORS OF ASPARTYL PROTEASE | Vertex Pharmaceuticals Incorporated (US) | 2001-03-28 | — | — | EP | disclosed |
| WO-1999065870-A2 | SULFONAMIDE INHIBITORS OF ASPARTYL PROTEASE | VERTEX PHARMACEUTICALS INCORPORATED (US) | 1999-12-23 | — | — | WO | disclosed |