Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 3/20 | 0.62 |
| ▸ | CASP1 | P29466 | 9/20 | 0.55 |
| ▸ | CASP7 | P55210 | 2/20 | 0.55 |
| ▸ | CTSK | P43235 | 4/20 | 0.43 |
| ▸ | CTSS | P25774 | 3/20 | 0.43 |
| ▸ | CTSL | P07711 | 2/20 | 0.43 |
| ▸ | CTSB | P07858 | 2/20 | 0.43 |
| ▸ | MME | P08473 | 1/20 | 0.43 |
| ▸ | ECE1 | P42892 | 1/20 | 0.43 |
| ▸ | REN | P00797 | 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 | |
|---|---|---|---|---|
| SCHEMBL7877666 | 0.92 | CASP3 (0.54) | CASP3CASP1CASP7CTSKCTSS | |
| SCHEMBL7890373 | 0.90 | CASP3 (0.59) | CASP3CASP1CASP7CTSKCTSS | |
| SCHEMBL9962171 | 0.85 | CASP3 (0.74) | CASP3CASP1CASP7CTSKCTSB | |
| SCHEMBL18781767 | 0.84 | CASP3 (0.78) | CASP3CASP1CASP7 | |
| SCHEMBL19015946 | 0.84 | CASP3 (0.60) | CASP3CASP1CASP7CTSLCTSB | |
| SCHEMBL19015914 | 0.83 | CASP3 (0.52) | CASP3CASP1CASP7CTSKCTSS | |
| SCHEMBL7888466 | 0.83 | CASP3 (0.52) | CASP3CASP1CASP7CTSKCTSS | |
| SCHEMBL19015809 | 0.82 | CASP3 (0.57) | CASP3CASP1CASP7CTSLCTSB | |
| SCHEMBL7882928 | 0.81 | CASP3 (0.70) | CASP3CASP1CASP7CTSKCTSB | |
| SCHEMBL7886229 | 0.81 | CTSS (0.58) | CASP3CASP1CASP7CTSKCTSS |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010133000-A1 | SELECTIVE CASPASE INHIBITORS AND USES THEREOF | NEW WORLD LABORATORIES INC. (CA) | 2010-11-25 | — | — | WO | disclosed |