Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CCKBR | P32239 | 10/20 | 0.41 |
| ▸ | CCKAR | P32238 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 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 | |
|---|---|---|---|---|
| SCHEMBL9039031 | 0.90 | CCKBR (0.50) | ALDH1A1AGTR1CCKBRCCKARANPEP | |
| SCHEMBL9048213 | 0.90 | CCKBR (0.51) | ALDH1A1AGTR1CCKBRTSHRANPEP | |
| SCHEMBL9040362 | 0.89 | CCKBR (0.52) | ALDH1A1HSD17B10CCKBRCCKARCYP3A4 | |
| SCHEMBL9039643 | 0.88 | ALDH1A1 (0.42) | ALDH1A1AGTR1HSD17B10CCKBRCCKAR | |
| SCHEMBL9040489 | 0.88 | CCKBR (0.47) | CCKBRCCKARCYP3A4MAPTTSHR | |
| SCHEMBL9039782 | 0.88 | CCKBR (0.49) | ALDH1A1AGTR1CCKBRCCKAR | |
| SCHEMBL9038073 | 0.85 | CYP3A4 (0.53) | CCKBRCCKARCYP3A4MAPTTSHR | |
| SCHEMBL9038776 | 0.85 | CCKAR (0.57) | CCKBRCCKARCYP3A4MAPTTSHR | |
| SCHEMBL9041314 | 0.85 | CCKBR (0.56) | ALDH1A1AGTR1CCKBR | |
| SCHEMBL9043273 | 0.84 | CCKBR (0.51) | ALDH1A1AGTR1CCKBRCCKAR |
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-0703222-A1 | 3-AMINOAZEPINE COMPOUND AND PHARMACEUTICAL USE THEREOF | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1996-03-27 | — | — | EP | disclosed |