Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 9/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 6/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.37 |
| ▸ | CASP9 | P55211 | 2/20 | 0.37 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.35 |
| ▸ | CYSLTR1 | Q9Y271 | 3/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19015824 | 0.83 | CASP3 (0.59) | CASP3CASP7CASP1CASP9CTSB | |
| SCHEMBL19015780 | 0.83 | CYP1A2 (0.46) | CASP3CYP1A2CASP7CASP1CASP9 | |
| SCHEMBL19015900 | 0.79 | CASP3 (0.51) | CASP3CASP7CASP1CASP9CTSS | |
| SCHEMBL19015889 | 0.72 | CASP3 (0.67) | CASP3CASP7CASP1CASP9CTSB | |
| SCHEMBL7888300 | 0.72 | CASP3 (0.67) | CASP3CASP7CASP1CASP9CTSB | |
| SCHEMBL9961871 | 0.72 | CASP3 (0.67) | CASP3CASP7CASP1CASP9CTSB | |
| SCHEMBL19015892 | 0.72 | CASP3 (0.37) | CASP3CASP7CASP1USP2 | |
| SCHEMBL19385958 | 0.72 | CYP1A2 (0.56) | CYP1A2 | |
| SCHEMBL19385959 | 0.72 | CYP1A2 (0.56) | CYP1A2 | |
| SCHEMBL14265380 | 0.71 | ACE (0.53) | CYP1A2SIRT2CTSBCTSSCTSK |
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 |