Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTRA1 | Q92743 | 1/20 | 0.38 |
| ▸ | XIAP | P98170 | 2/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | CTSC | P53634 | 4/20 | 0.33 |
| ▸ | PREP | P48147 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 3/20 | 0.33 |
| ▸ | CCKBR | P32239 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17485287 | 1.00 | HTRA1 (0.38) | HTRA1XIAPSCN9ACTSCPREP | |
| SCHEMBL20384073 | 1.00 | HTRA1 (0.38) | HTRA1XIAPSCN9ACTSCPREP | |
| SCHEMBL20384081 | 0.89 | HTRA1 (0.37) | HTRA1XIAPSCN9ACTSCPREP | |
| SCHEMBL16078767 | 0.89 | HTRA1 (0.37) | HTRA1XIAPSCN9ACTSCPREP | |
| SCHEMBL16064063 | 0.87 | HTRA1 (0.37) | HTRA1XIAPSCN9ACTSCPREP | |
| SCHEMBL16064478 | 0.84 | CTSC (0.39) | HTRA1XIAPSCN9ACTSCPREP | |
| SCHEMBL20384132 | 0.84 | CTSC (0.39) | HTRA1XIAPSCN9ACTSCPREP | |
| SCHEMBL16064205 | 0.81 | CTSC (0.46) | HTRA1XIAPCTSCPREPMCL1 | |
| SCHEMBL16064451 | 0.80 | CTSC (0.51) | HTRA1XIAPCTSCPREPCTSK | |
| SCHEMBL16064477 | 0.79 | CTSC (0.39) | HTRA1XIAPSCN9ACTSCPREP |
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-3174879-B1 | SUBSTITUTED OXETANES AND THEIR USE AS INHIBITORS OF CATHEPSIN C | BOEHRINGER INGELHEIM INT (DE) | 2018-07-18 | — | — | EP | disclosed |