Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL12046989 | 0.95 | CASP1 (0.39) | CASP1CASP3 | |
| SCHEMBL8320800 | 0.95 | CASP1 (0.39) | CASP1CASP3 | |
| SCHEMBL13638408 | 0.90 | CASP1 (0.41) | CASP1CASP3 | |
| SCHEMBL12046795 | 0.90 | CASP1 (0.39) | CASP1CASP3 | |
| SCHEMBL12046805 | 0.89 | CASP1 (0.38) | CASP1CASP3 | |
| SCHEMBL87375 | 0.88 | CASP1 (0.37) | CASP1CASP3 | |
| SCHEMBL8321712 | 0.88 | CASP1 (0.37) | CASP1CASP3 | |
| SCHEMBL12046809 | 0.88 | CASP1 (0.39) | CASP1CASP3 | |
| SCHEMBL12046793 | 0.88 | CASP1 (0.37) | CASP1CASP3 | |
| SCHEMBL3582995 | 0.88 | CASP3 (0.38) | CASP1CASP3 |
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 |
|---|---|---|---|---|---|---|---|
| US-7612091-B2 | Caspase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-11-03 | — | — | US | disclosed |
| US-7612091-B2 | Caspase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-11-03 | — | — | US | disclosed |