Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 20/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL24981555 | 1.00 | CTSC (0.54) | CTSCKCNH2 | |
| SCHEMBL29455330 | 1.00 | CTSC (0.54) | CTSCKCNH2 | |
| SCHEMBL25146371 | 1.00 | CTSC (0.54) | CTSCKCNH2 | |
| SCHEMBL31095829 | 0.92 | CTSC (0.53) | CTSCKCNH2 | |
| SCHEMBL31095791 | 0.92 | CTSC (0.53) | CTSCKCNH2 | |
| SCHEMBL16932289 | 0.90 | CTSC (0.68) | CTSCKCNH2 | |
| SCHEMBL25267517 | 0.90 | CTSC (0.68) | CTSCKCNH2 | |
| SCHEMBL31758812 | 0.90 | CTSC (0.49) | CTSCKCNH2 | |
| SCHEMBL31095834 | 0.90 | CTSC (0.54) | CTSCKCNH2 | |
| SCHEMBL31095609 | 0.90 | CTSC (0.54) | CTSCKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115996923-A | Nitrile derivative as dipeptidyl peptidase 1 inhibitor and application thereof | 四川海思科制药有限公司 | 2023-04-21 | — | — | CN | disclosed |