Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKAR | P32238 | 1/20 | 0.49 |
| ▸ | CCKBR | P32239 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 7/20 | 0.48 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.48 |
| ▸ | GRPR | P30550 | 1/20 | 0.48 |
| ▸ | CTSD | P07339 | 1/20 | 0.47 |
| ▸ | CALCR | P30988 | 2/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Neurokinin B SCHEMBL29372314 | 0.96 | GRPR (0.53) | CCKARCCKBRGRPRKEAP1 | |
| SCHEMBL29972794 | 0.90 | TACR3 (0.56) | CCKARCCKBR | |
| SCHEMBL30712910 | 0.89 | KEAP1 (0.54) | BACE1BACE2GRPRCALCRKEAP1 | |
| SCHEMBL29720259 | 0.87 | CALCR (0.58) | BACE1CALCRKEAP1 | |
| SCHEMBL29972919 | 0.85 | F2 (0.55) | CALCR | |
| SCHEMBL29406603 | 0.84 | CTSB (0.54) | CCKARCCKBRBACE1BACE2 | |
| SCHEMBL29635518 | 0.84 | APLNR (0.48) | BACE1CALCR | |
| SCHEMBL29416052 | 0.83 | BACE1 (0.55) | BACE1BACE2CTSD | |
| SCHEMBL29941145 | 0.83 | CCKAR (0.42) | CCKARCCKBRCALCRKEAP1 | |
| SCHEMBL31548694 | 0.82 | BACE1 (0.58) | BACE1BACE2GRPRCTSD |
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-4067370-A1 | HIGH PENETRATION PRODRUG COMPOSITIONS OF PEPTIDES AND PEPTIDE RELATED COMPOUNDS | Yu, Chongxi (US) | 2022-10-05 | — | — | EP | disclosed |