Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CCKAR | P32238 | 16/20 | 0.47 |
| ▸ | CCKBR | P32239 | 14/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8796363 | 0.90 | ALDH1A1 (0.62) | ALDH1A1CCKARCCKBR | |
| Bromide SCHEMBL8795194 | 0.89 | ALDH1A1 (0.61) | ALDH1A1CCKARCCKBR | |
| SCHEMBL8798046 | 0.83 | SENP1 (0.52) | ALDH1A1CCKARCCKBR | |
| SCHEMBL8794022 | 0.79 | ALDH1A1 (0.60) | ALDH1A1CCKARCCKBR | |
| Bromide SCHEMBL8795033 | 0.78 | ALDH1A1 (0.59) | ALDH1A1CCKARCCKBR | |
| Bromide SCHEMBL8795037 | 0.78 | ALDH1A1 (0.59) | ALDH1A1CCKARCCKBR | |
| SCHEMBL8552734 | 0.78 | POLB (0.44) | ALDH1A1CCKARCCKBR | |
| SCHEMBL8795883 | 0.72 | ALDH1A1 (0.58) | ALDH1A1CCKARCCKBR | |
| SCHEMBL8703893 | 0.71 | ALDH1A1 (0.57) | ALDH1A1CCKARCCKBR | |
| SCHEMBL8797565 | 0.70 | CCKAR (0.48) | ALDH1A1CCKARCCKBR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6096885-A | EXHIBIT AGONIST ACTIVITY FOR CCK-A RECEPTORS THEREBY ENABLING THEM TO MODULATE THE HORMONES GASTRIN AND CHOLECYSTOKININ IN MAMMALS. | GLAXO WELLCOME INC. (US) | 2000-08-01 | — | — | US | disclosed |
| EP-0785944-A1 | ACYL AMINO ACETAMIDE DERIVATIVES WITH AGONIST ACTIVITY FOR CCK-A RECEPTORS | GLAXO WELLCOME INC. (US) | 1997-07-30 | — | — | EP | disclosed |
| WO-1996011940-A1 | ACYL AMINO ACETAMIDE DERIVATIVES WITH AGONIST ACTIVITY FOR CCK-A RECEPTORS | GLAXO WELLCOME INC. (US) | 1996-04-25 | — | — | WO | disclosed |