Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 20/20 | 0.75 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL30990380 | 1.00 | CTSC (0.75) | CTSCKCNH2 | |
| SCHEMBL27377581 | 1.00 | CTSC (0.75) | CTSCKCNH2 | |
| SCHEMBL30990379 | 1.00 | CTSC (0.75) | CTSCKCNH2 | |
| SCHEMBL28694106 | 1.00 | CTSC (0.75) | CTSCKCNH2 | |
| SCHEMBL30987109 | 0.94 | CTSC (0.76) | CTSCKCNH2 | |
| SCHEMBL29294675 | 0.94 | CTSC (0.76) | CTSCKCNH2 | |
| SCHEMBL30987043 | 0.94 | CTSC (0.76) | CTSCKCNH2 | |
| SCHEMBL30987101 | 0.94 | CTSC (0.76) | CTSCKCNH2 | |
| SCHEMBL30987090 | 0.94 | CTSC (0.76) | CTSCKCNH2 | |
| SCHEMBL30987162 | 0.93 | CTSC (0.77) | 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-114106005-A | Nitrile derivative as dipeptidyl peptidase 1 inhibitor and application thereof | 四川海思科制药有限公司 | 2022-03-01 | — | — | CN | disclosed |