Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGL | P06737 | 2/20 | 0.44 |
| ▸ | CCKBR | P32239 | 5/20 | 0.42 |
| ▸ | ACE | P12821 | 4/20 | 0.41 |
| ▸ | MME | P08473 | 3/20 | 0.41 |
| ▸ | CCKAR | P32238 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8520674 | 0.87 | CCKBR (0.42) | PYGLCCKBRCCKARHTR1A | |
| SCHEMBL5712951 | 0.87 | CCKBR (0.42) | PYGLCCKBRCCKARHTR1A | |
| SCHEMBL7446421 | 0.85 | CASP1 (0.39) | PYGLCCKBR | |
| SCHEMBL645168 | 0.78 | XIAP (0.46) | — | |
| SCHEMBL7446425 | 0.77 | CASP1 (0.32) | PYGLHTR1A | |
| SCHEMBL5712978 | 0.74 | CASP1 (0.46) | PYGLCCKBRCCKAR | |
| SCHEMBL8521265 | 0.74 | CASP1 (0.46) | PYGLCCKBRCCKAR | |
| SCHEMBL644932 | 0.71 | XIAP (0.45) | PYGLACEMME | |
| SCHEMBL647728 | 0.69 | XIAP (0.42) | — | |
| SCHEMBL5712998 | 0.69 | ACE (0.46) | ACEMME |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0942925-B1 | INHIBITORS OF INTERLEUKIN-1 BETA CONVERTING ENZYME | VERTEX PHARMA (US) | 2006-11-22 | — | — | EP | disclosed |
| EP-1466921-A1 | Inhibitors of interleukin-1 beta converting enzyme | Vertex Pharmaceuticals Incorporated (US) | 2004-10-13 | — | — | EP | disclosed |
| US-6350741-B1 | 1-BENZAZEPINE DERIVATIVES; ANTIINFLAMMATORY, ANTIARTHRITIC AGENTS; BONE AND AUTOIMMUNE DISORDER TREATMENT | VERTEX PHARMACEUTICAL, INC. | 2002-02-26 | — | — | US | disclosed |
| EP-0942925-A2 | INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME | Vertex Pharmaceuticals Incorporated (US) | 1999-09-22 | — | — | EP | disclosed |
| WO-1998024804-A2 | INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME | VERTEX PHARMACEUTICALS INCORPORATED (US) | 1998-06-11 | — | — | WO | disclosed |