Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 7/20 | 0.51 |
| ▸ | CCKAR | P32238 | 3/20 | 0.51 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.51 |
| ▸ | PYGL | P06737 | 2/20 | 0.46 |
| ▸ | ACE | P12821 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9542670 | 1.00 | CCKBR (0.51) | CCKBRCCKARCYP51A1PYGLACE | |
| SCHEMBL9545032 | 0.87 | CCKBR (0.51) | CCKBRCCKARCYP51A1PYGL | |
| SCHEMBL9542540 | 0.87 | CCKBR (0.51) | CCKBRCCKARCYP51A1PYGL | |
| SCHEMBL9544385 | 0.81 | CCKBR (0.49) | CCKBRCCKARCYP51A1PYGL | |
| SCHEMBL9542711 | 0.80 | CCKBR (0.47) | CCKBRCCKARCYP51A1PYGL | |
| SCHEMBL9544117 | 0.79 | CYP51A1 (0.59) | CCKBRCCKARCYP51A1PYGL | |
| SCHEMBL9544112 | 0.79 | CYP51A1 (0.59) | CCKBRCCKARCYP51A1PYGL | |
| SCHEMBL9543666 | 0.79 | PYGL (0.56) | CYP51A1PYGL | |
| SCHEMBL9543543 | 0.79 | CYP51A1 (0.53) | CCKBRCCKARCYP51A1PYGL | |
| SCHEMBL9548135 | 0.77 | CCKBR (0.47) | CCKBRCCKARCYP51A1PYGL |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993020099-A2 | CCK AND/OR GASTRIN RECEPTOR LIGANDS | FERRING B.V. (NL) | 1993-10-14 | — | — | WO | claimed |