Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 14/20 | 0.46 |
| ▸ | CTSS | P25774 | 6/20 | 0.46 |
| ▸ | CTSB | P07858 | 2/20 | 0.42 |
| ▸ | CTSC | P53634 | 12/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29455573 | 1.00 | CTSK (0.46) | CTSKCTSSCTSBCTSCNR1H2 | |
| SCHEMBL24981066 | 1.00 | CTSK (0.46) | CTSKCTSSCTSBCTSCNR1H2 | |
| SCHEMBL28989335 | 0.81 | APP (0.38) | CTSKCTSCNR1H2NR1H3 | |
| SCHEMBL29455631 | 0.81 | CTSC (0.45) | CTSKCTSC | |
| SCHEMBL24981067 | 0.81 | CTSC (0.45) | CTSKCTSC | |
| SCHEMBL28989362 | 0.81 | CTSC (0.45) | CTSKCTSC | |
| SCHEMBL24981724 | 0.81 | APP (0.42) | CTSKCTSSCTSC | |
| SCHEMBL30738857 | 0.80 | CTSK (0.49) | CTSKCTSSCTSBCTSC | |
| SCHEMBL24981973 | 0.78 | CTSC (0.63) | CTSKCTSSCTSC | |
| SCHEMBL25371156 | 0.78 | CTSC (0.63) | CTSKCTSSCTSC |
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 |