Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 13/20 | 0.46 |
| ▸ | CTSS | P25774 | 10/20 | 0.46 |
| ▸ | CTSL | P07711 | 3/20 | 0.46 |
| ▸ | CTSB | P07858 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4998308 | 0.83 | CTSK (0.58) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL2910891 | 0.83 | CTSK (0.58) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL13263256 | 0.82 | CTSK (0.50) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL24260538 | 0.81 | CTSK (0.44) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL21367947 | 0.77 | CTSK (0.46) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL13293164 | 0.77 | CTSS (0.46) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL5958657 | 0.77 | CTSK (0.56) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL15259348 | 0.77 | CTSK (0.56) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL23749245 | 0.75 | CTSK (0.44) | CTSKCTSSCTSLCTSBCA1 | |
| SCHEMBL18762487 | 0.75 | CTSK (0.48) | CTSKCTSSCTSLCTSBCA1 |
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 |