Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 16/20 | 0.58 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.56 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.51 |
| ▸ | CCKAR | P32238 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9303058 | 1.00 | CCKBR (0.58) | CCKBRSCN9ASENP1CCKARKCNH2 | |
| SCHEMBL9303063 | 1.00 | CCKBR (0.58) | CCKBRSCN9ASENP1CCKARKCNH2 | |
| SCHEMBL8824724 | 0.99 | CCKBR (0.59) | CCKBRSCN9ASENP1CCKARKCNH2 | |
| SCHEMBL4418545 | 0.99 | CCKBR (0.59) | CCKBRSCN9ASENP1CCKARKCNH2 | |
| SCHEMBL8824753 | 0.99 | CCKBR (0.59) | CCKBRSCN9ASENP1CCKARKCNH2 | |
| SCHEMBL8824750 | 0.99 | CCKBR (0.59) | CCKBRSCN9ASENP1CCKARKCNH2 | |
| SCHEMBL8824754 | 0.99 | CCKBR (0.59) | CCKBRSCN9ASENP1CCKARKCNH2 | |
| SCHEMBL8824720 | 0.99 | CCKBR (0.59) | CCKBRSCN9ASENP1CCKARKCNH2 | |
| SCHEMBL8893570 | 0.98 | CCKBR (0.58) | CCKBRSCN9ASENP1KCNH2 | |
| SCHEMBL8893575 | 0.98 | CCKBR (0.58) | CCKBRSCN9ASENP1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5360802-A | Antagonists of cholecystokinin and gastrin | MERCK SHARPE & DOHME LTD. | 1994-11-01 | — | — | US | disclosed |
| EP-0514133-A1 | Benzodiazepine derivatives, compositions containing them and their use in therapy | MERCK SHARP & DOHME LTD. (GB) | 1992-11-19 | — | — | EP | disclosed |