Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 4/20 | 0.42 |
| ▸ | CCKAR | P32238 | 3/20 | 0.39 |
| ▸ | PYGL | P06737 | 1/20 | 0.38 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5712951 | 1.00 | CCKBR (0.42) | CCKBRCCKARPYGLSENP1HTR1A | |
| SCHEMBL5712995 | 0.87 | PYGL (0.44) | CCKBRCCKARPYGLHTR1A | |
| SCHEMBL5712987 | 0.81 | CCKBR (0.45) | CCKBR | |
| SCHEMBL8521032 | 0.81 | CCKBR (0.45) | CCKBR | |
| SCHEMBL7446421 | 0.78 | CASP1 (0.39) | CCKBRPYGL | |
| SCHEMBL6674788 | 0.77 | CASP1 (0.46) | CCKBR | |
| SCHEMBL8520881 | 0.77 | CASP1 (0.46) | CCKBR | |
| Hydrochloric Acid SCHEMBL5713016 | 0.74 | CCKBR (0.46) | CCKBRCCKARSENP1 | |
| SCHEMBL646039 | 0.73 | CASP1 (0.50) | CCKBR | |
| SCHEMBL7568437 | 0.72 | CCKBR (0.46) | CCKBRCCKAR |
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-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 |