Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 10/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9544802 | 0.90 | ACE (0.46) | ACEABCB11PTPN1 | |
| SCHEMBL9544279 | 0.84 | CTSK (0.52) | ACEABCB11HDAC8 | |
| SCHEMBL9543839 | 0.83 | ACE (0.43) | ACE | |
| SCHEMBL9544975 | 0.82 | CTSK (0.51) | ACE | |
| SCHEMBL9544256 | 0.82 | CTSK (0.51) | ACE | |
| SCHEMBL9542916 | 0.79 | ACE (0.39) | ACEABCB11 | |
| SCHEMBL9543218 | 0.78 | CYP1A2 (0.44) | ACE | |
| SCHEMBL9542952 | 0.77 | ELANE (0.40) | ACE | |
| SCHEMBL9542953 | 0.77 | ELANE (0.40) | ACE | |
| SCHEMBL9544106 | 0.76 | ELANE (0.47) | — |
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 2 patents. 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 |
| WO-1993020099-A2 | CCK AND/OR GASTRIN RECEPTOR LIGANDS | FERRING B.V. (NL) | 1993-10-14 | — | — | WO | disclosed |