Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 15/20 | 0.45 |
| ▸ | CTSK | P43235 | 15/20 | 0.45 |
| ▸ | CTSB | P07858 | 4/20 | 0.39 |
| ▸ | CTSL | P07711 | 2/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.36 |
| ▸ | CTSC | P53634 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16064303 | 0.84 | CTSS (0.52) | CTSSCTSKCTSBCTSLTRPA1 | |
| SCHEMBL19858727 | 0.84 | CTSS (0.52) | CTSSCTSKCTSBCTSLTRPA1 | |
| SCHEMBL19154996 | 0.80 | CTSS (0.52) | CTSSCTSKCTSBCTSLTRPA1 | |
| SCHEMBL31757716 | 0.79 | CTSL (0.52) | CTSSCTSKCTSBCTSLTRPA1 | |
| SCHEMBL16064145 | 0.79 | CTSK (0.51) | CTSSCTSKCTSBCTSLTRPA1 | |
| SCHEMBL30738857 | 0.76 | CTSK (0.49) | CTSSCTSKCTSBCTSLCTSC | |
| SCHEMBL12070028 | 0.76 | MTNR1A (0.45) | AAK1 | |
| SCHEMBL16064445 | 0.75 | CTSS (0.45) | CTSSCTSKCTSBCTSLTRPA1 | |
| SCHEMBL28989398 | 0.75 | CTSS (0.45) | CTSSCTSKCTSBCTSLTRPA1 | |
| SCHEMBL30219006 | 0.75 | CTSS (0.45) | CTSSCTSKCTSBCTSLTRPA1 |
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-4129989-A1 | NITRILE DERIVATIVE THAT ACTS AS INHIBITOR OF DIPEPTIDYL PEPTIDASE 1 AND USE THEREOF | Haisco Pharmaceuticals Pte. Ltd. (SG) | 2023-02-08 | — | — | EP | disclosed |