Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 6/20 | 0.47 |
| ▸ | CASP7 | P55210 | 3/20 | 0.45 |
| ▸ | CASP1 | P29466 | 3/20 | 0.45 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | ECE1 | P42892 | 2/20 | 0.42 |
| ▸ | MME | P08473 | 1/20 | 0.42 |
| ▸ | REN | P00797 | 2/20 | 0.42 |
| ▸ | CTSB | P07858 | 2/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | NMBR | P28336 | 1/20 | 0.41 |
| ▸ | CASP9 | P55211 | 2/20 | 0.40 |
| ▸ | CCKAR | P32238 | 1/20 | 0.40 |
| ▸ | CCKBR | P32239 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20052423 | 1.00 | CASP3 (0.47) | CASP3CASP7CASP1MMP9MMP8 | |
| SCHEMBL20052446 | 0.92 | CASP3 (0.43) | CASP3CASP7CASP1ECE1MME | |
| SCHEMBL20356041 | 0.92 | CASP3 (0.43) | CASP3CASP7CASP1ECE1MME | |
| SCHEMBL19944793 | 0.91 | CASP3 (0.45) | CASP3CASP7CASP1MMP9MMP8 | |
| SCHEMBL20052454 | 0.91 | CASP3 (0.45) | CASP3CASP7CASP1MMP9MMP8 | |
| SCHEMBL15462692 | 0.89 | MMP9 (0.46) | CASP3MMP9MMP8IDO1REN | |
| SCHEMBL15462695 | 0.87 | CASP3 (0.65) | CASP3CASP7CASP1CASP9 | |
| SCHEMBL20355913 | 0.87 | CASP3 (0.65) | CASP3CASP7CASP1CASP9 | |
| SCHEMBL20355912 | 0.87 | CASP3 (0.65) | CASP3CASP7CASP1CASP9 | |
| SCHEMBL20052371 | 0.87 | CASP3 (0.65) | CASP3CASP7CASP1CASP9 |
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 |
|---|---|---|---|---|---|---|---|
| US-9944674-B2 | Selective cysteine protease inhibitors and uses thereof | GENESIS TECHNOLOGIES LIMITED (BB) | 2018-04-17 | — | — | US | disclosed |