Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 19/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1409729 | 0.85 | CASP1 (0.48) | CASP1 | |
| SCHEMBL7256039 | 0.85 | CASP1 (0.50) | CASP1 | |
| SCHEMBL646040 | 0.85 | CASP1 (0.65) | CASP1 | |
| SCHEMBL7345424 | 0.78 | CASP1 (0.44) | CASP1HPGD | |
| SCHEMBL8398037 | 0.75 | CASP1 (0.47) | CASP1 | |
| SCHEMBL4457274 | 0.75 | CASP1 (0.47) | CASP1 | |
| SCHEMBL12522514 | 0.74 | CASP1 (0.63) | CASP1 | |
| SCHEMBL949463 | 0.74 | CASP1 (0.63) | CASP1 | |
| SCHEMBL7005599 | 0.72 | CASP1 (0.43) | CASP1 | |
| SCHEMBL13139829 | 0.71 | CASP1 (0.50) | CASP1CYP1A2CYP3A4CYP2C19 |
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-0784628-A1 | INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME | Vertex Pharmaceuticals Incorporated (US) | 1997-07-23 | — | — | EP | disclosed |
| WO-1995035308-A1 | INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME | VERTEX PHARMACEUTICALS INCORPORATED (US) | 1995-12-28 | — | — | WO | disclosed |