Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 7/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 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 | |
|---|---|---|---|---|
| SCHEMBL9542436 | 0.92 | OPRD1 (0.36) | — | |
| SCHEMBL9542902 | 0.91 | ACE (0.41) | ACE | |
| SCHEMBL9545027 | 0.85 | ACE (0.38) | ACEPOLB | |
| SCHEMBL9542806 | 0.85 | ACE (0.38) | ACEPOLB | |
| SCHEMBL9544357 | 0.85 | ACE (0.38) | ACEPOLB | |
| SCHEMBL9543922 | 0.84 | ACE (0.42) | ACEPOLBABCB11 | |
| SCHEMBL9543430 | 0.81 | POLB (0.39) | ACEPOLB | |
| SCHEMBL9544782 | 0.79 | OPRD1 (0.36) | — | |
| SCHEMBL9544069 | 0.79 | OPRD1 (0.36) | — | |
| SCHEMBL9543964 | 0.79 | ABCB1 (0.41) | ACEABCB11 |
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 | disclosed |