Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.52 |
| ▸ | CCKBR | P32239 | 7/20 | 0.51 |
| ▸ | OXTR | P30559 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | CCKAR | P32238 | 5/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.47 |
| ▸ | CALCRL | Q16602 | 2/20 | 0.47 |
| ▸ | RAMP1 | O60894 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8547267 | 0.88 | CCKBR (0.57) | SENP1CCKBRCCKARSCN9A | |
| SCHEMBL9592825 | 0.84 | CCKBR (0.63) | SENP1CCKBRCCKAR | |
| SCHEMBL13063327 | 0.84 | CCKBR (0.70) | CCKBRCCKARSCN9A | |
| SCHEMBL4416422 | 0.83 | CCKBR (0.58) | CCKBROXTRKCNH2CCKARCALCRL | |
| SCHEMBL4992377 | 0.78 | PSEN1 (0.55) | CCKBROXTRKCNH2CCKAR | |
| SCHEMBL4994865 | 0.76 | PSEN1 (0.55) | CCKBROXTRKCNH2CALCRLRAMP1 | |
| SCHEMBL4988954 | 0.76 | KCNH2 (0.56) | CCKBROXTRKCNH2CCKAR | |
| SCHEMBL11981817 | 0.75 | BRD4 (0.73) | CCKBR | |
| SCHEMBL11981782 | 0.75 | BRD4 (0.73) | CCKBR | |
| SCHEMBL8795129 | 0.75 | CCKBR (0.61) | CCKBRCCKAR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0508796-B1 | Cholecystokinin antagonists | MERCK & CO INC (US) | 1998-07-08 | — | — | EP | disclosed |
| US-5220018-A | Benzodiazepine derivatives | MERCK & CO., INC. (US) | 1993-06-15 | — | — | US | disclosed |
| EP-0508796-A1 | Cholecystokinin antagonists | MERCK & CO. INC. (US) | 1992-10-14 | — | — | EP | disclosed |