Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9544136 | 0.93 | ALDH1A1 (0.39) | ACEOPRM1OPRL1 | |
| SCHEMBL9544913 | 0.91 | ACE (0.41) | ACE | |
| SCHEMBL9544945 | 0.89 | ACE (0.39) | ACE | |
| SCHEMBL9542714 | 0.86 | PREP (0.41) | ACE | |
| SCHEMBL9544776 | 0.86 | ACE (0.40) | ACE | |
| SCHEMBL9544284 | 0.85 | DRD4 (0.43) | — | |
| SCHEMBL9544292 | 0.84 | ALDH1A1 (0.48) | — | |
| SCHEMBL9543652 | 0.84 | ACE (0.38) | ACE | |
| SCHEMBL9544100 | 0.83 | JAK2 (0.40) | OPRM1OPRL1 | |
| SCHEMBL9543607 | 0.83 | ALDH1A1 (0.39) | — |
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 |