Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 1/20 | 0.47 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.37 |
| ▸ | XIAP | P98170 | 2/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.37 |
| ▸ | CTSL | P07711 | 2/20 | 0.35 |
| ▸ | CTSB | P07858 | 2/20 | 0.35 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16064115 | 0.79 | PREP (0.42) | DPP4USP30XIAPAAK1P2RX7 | |
| SCHEMBL18643728 | 0.79 | PREP (0.42) | DPP4USP30XIAPAAK1P2RX7 | |
| SCHEMBL22643222 | 0.77 | DPP4 (0.38) | DPP4USP30XIAPAAK1CTSS | |
| SCHEMBL16078754 | 0.77 | DPP4 (0.38) | DPP4USP30XIAPAAK1CTSS | |
| SCHEMBL16035979 | 0.77 | AAK1 (0.51) | AAK1CTSBCTSSCTSKALDH1A1 | |
| SCHEMBL30476240 | 0.77 | AAK1 (0.51) | AAK1CTSBCTSSCTSKALDH1A1 | |
| SCHEMBL19858738 | 0.77 | AAK1 (0.51) | AAK1CTSBCTSSCTSKALDH1A1 | |
| SCHEMBL21076266 | 0.76 | USP30 (0.37) | DPP4USP30XIAPAAK1P2RX7 | |
| SCHEMBL22642842 | 0.73 | PREP (0.40) | DPP4USP30AAK1GPR119SCN9A | |
| SCHEMBL16078799 | 0.73 | PREP (0.40) | DPP4USP30AAK1GPR119SCN9A |
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-2970283-B1 | SUBSTITUTED 2-AZA-BICYCLO[2.2.1]HEPTANE-3-CARBOXYLIC ACID (BENZYL-CYANO-METHYL)-AMIDES INHIBITORS OF CATHEPSIN C | BOEHRINGER INGELHEIM INT (DE) | 2020-11-11 | — | — | EP | disclosed |