Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 14/20 | 0.52 |
| ▸ | CTSK | P43235 | 11/20 | 0.52 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.37 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.37 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.37 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28989685 | 0.86 | CTSC (0.54) | CTSCCTSK | |
| SCHEMBL28989377 | 0.86 | CTSC (0.48) | CTSCCTSK | |
| SCHEMBL29455619 | 0.81 | CTSC (0.62) | CTSCCTSK | |
| SCHEMBL28705313 | 0.81 | CTSC (0.55) | CTSCCTSK | |
| SCHEMBL28989684 | 0.81 | CTSC (0.62) | CTSCCTSK | |
| SCHEMBL24982370 | 0.81 | CTSC (0.62) | CTSCCTSK | |
| SCHEMBL28989289 | 0.79 | CTSC (0.56) | CTSCCTSK | |
| SCHEMBL28989367 | 0.79 | CTSC (0.50) | CTSCCTSK | |
| SCHEMBL28989420 | 0.78 | CTSC (0.41) | CTSCCTSKGPR119 | |
| SCHEMBL24982365 | 0.77 | CTSC (0.56) | CTSCCTSKCLK4DYRK1BTYRO3 |
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 |