Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 3/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | GZMB | P10144 | 2/20 | 0.36 |
| ▸ | CTSB | P07858 | 2/20 | 0.31 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.30 |
| ▸ | XIAP | P98170 | 2/20 | 0.30 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19015975 | 0.89 | CASP3 (0.44) | CASP3CASP7CASP1GZMBCTSB | |
| SCHEMBL19015901 | 0.84 | CASP3 (0.59) | CASP3CASP7CASP1CTSB | |
| SCHEMBL19015831 | 0.84 | CASP3 (0.43) | CASP3CASP7CASP1 | |
| SCHEMBL19015773 | 0.82 | CASP3 (0.37) | CASP3CASP7CASP1 | |
| SCHEMBL19015847 | 0.81 | CASP3 (0.45) | CASP3CASP7CASP1 | |
| SCHEMBL19015809 | 0.81 | CASP3 (0.57) | CASP3CASP7CASP1CTSB | |
| SCHEMBL19015829 | 0.77 | CASP3 (0.60) | CASP3CASP7CASP1CTSB | |
| SCHEMBL19015925 | 0.77 | CASP3 (0.53) | CASP3CASP7CASP1CTSB | |
| SCHEMBL19015902 | 0.73 | CASP3 (0.56) | CASP3CASP7CASP1CTSB | |
| SCHEMBL7879121 | 0.71 | CASP3 (0.77) | CASP3CASP7CASP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2288615-B1 | SELECTIVE CASPASE INHIBITORS AND USES THEREOF | GENESIS TECH LTD (BB) | 2017-06-21 | — | — | EP | disclosed |