Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 13/20 | 0.69 |
| ▸ | CCKAR | P32238 | 11/20 | 0.69 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.51 |
| ▸ | NOTCH1 | P46531 | 1/20 | 0.49 |
| ▸ | RBPJ | Q06330 | 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 | |
|---|---|---|---|---|
| SCHEMBL642206 | 0.86 | CCKBR (0.76) | CCKBRCCKARSCN9ANOTCH1RBPJ | |
| SCHEMBL644153 | 0.85 | CCKBR (0.74) | CCKBRCCKAR | |
| SCHEMBL8774740 | 0.85 | CCKBR (0.74) | CCKBRCCKAR | |
| SCHEMBL5656206 | 0.85 | CCKBR (0.74) | CCKBRCCKAR | |
| SCHEMBL9526550 | 0.81 | CCKAR (1.00) | CCKBRCCKARSCN9ANOTCH1RBPJ | |
| SCHEMBL9526556 | 0.81 | CCKAR (1.00) | CCKBRCCKARSCN9ANOTCH1RBPJ | |
| SCHEMBL8746534 | 0.81 | CCKAR (1.00) | CCKBRCCKARSCN9ANOTCH1RBPJ | |
| SCHEMBL8746538 | 0.81 | CCKAR (1.00) | CCKBRCCKARSCN9ANOTCH1RBPJ | |
| SCHEMBL643214 | 0.80 | CCKBR (0.63) | CCKBRCCKAR | |
| SCHEMBL10409010 | 0.78 | CCKBR (0.65) | CCKBRCCKARNOTCH1RBPJ |
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 |
|---|---|---|---|---|---|---|---|
| US-5004741-A | Cholecystokinin(CCK); Treating Disorders Of The Gastrointestinal Tract, Central Nervous System And Of The Appetite Of Animals | MERCK & CO., INC. (US) | 1991-04-02 | — | — | US | disclosed |
| US-4820834-A | Benzodiazepine analogs | MERCK & CO., INC. (US) | 1989-04-11 | — | — | US | disclosed |
| EP-0284256-A1 | Benzodiazepine analogs | MERCK & CO. INC. (US) | 1988-09-28 | — | — | EP | disclosed |