Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 5/20 | 0.53 |
| ▸ | CASP7 | P55210 | 3/20 | 0.49 |
| ▸ | CASP1 | P29466 | 2/20 | 0.49 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.39 |
| ▸ | CTSL | P07711 | 8/20 | 0.39 |
| ▸ | CTSB | P07858 | 8/20 | 0.39 |
| ▸ | KLK7 | P49862 | 1/20 | 0.38 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.38 |
| ▸ | CASP2 | P42575 | 1/20 | 0.37 |
| ▸ | CASP4 | P49662 | 1/20 | 0.37 |
| ▸ | CASP5 | P51878 | 1/20 | 0.37 |
| ▸ | CASP9 | P55211 | 1/20 | 0.37 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.37 |
| ▸ | CASP10 | Q92851 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19015946 | 0.94 | CASP3 (0.60) | CASP3CASP7CASP1CTSLCTSB | |
| SCHEMBL19015809 | 0.91 | CASP3 (0.57) | CASP3CASP7CASP1CTSLCTSB | |
| SCHEMBL19015901 | 0.91 | CASP3 (0.59) | CASP3CASP7CASP1CTSLCTSB | |
| SCHEMBL18782310 | 0.88 | CASP3 (0.69) | CASP3CASP7CASP1PSMB5CASP2 | |
| SCHEMBL19015773 | 0.84 | CASP3 (0.37) | CASP3CASP7CASP1 | |
| SCHEMBL7877666 | 0.84 | CASP3 (0.54) | CASP3CASP7CASP1MMP8CTSL | |
| SCHEMBL19015914 | 0.84 | CASP3 (0.52) | CASP3CASP7CASP1MMP8PSMB5 | |
| SCHEMBL7888466 | 0.84 | CASP3 (0.52) | CASP3CASP7CASP1MMP8PSMB5 | |
| SCHEMBL19015829 | 0.84 | CASP3 (0.60) | CASP3CASP7CASP1CTSLCTSB | |
| SCHEMBL18781767 | 0.81 | CASP3 (0.78) | CASP3CASP7CASP1PSMB5CASP2 |
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 |