Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 9/20 | 0.49 |
| ▸ | CCKAR | P32238 | 8/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7544285 | 0.79 | CCKBR (0.43) | CCKBRCCKARKDM4ENLRP3ALDH1A1 | |
| SCHEMBL7544295 | 0.79 | CCKBR (0.43) | CCKBRCCKARKDM4ENLRP3ALDH1A1 | |
| SCHEMBL11882312 | 0.77 | CCKBR (0.50) | CCKBRCCKARKDM4ENLRP3ALDH1A1 | |
| SCHEMBL7546577 | 0.75 | CCKBR (0.52) | CCKBRCCKAR | |
| SCHEMBL2364518 | 0.69 | GABRA1 (0.54) | CCKBRCCKAR | |
| SCHEMBL5418368 | 0.69 | MEN1 (0.59) | CCKBRCCKAR | |
| SCHEMBL10338752 | 0.69 | KDM4E (0.57) | KDM4ENLRP3ALDH1A1HSD17B10 | |
| SCHEMBL6307970 | 0.68 | CCKBR (0.53) | CCKBRCCKAR | |
| SCHEMBL6157468 | 0.68 | MEN1 (0.45) | CCKBRCCKARKDM4EALDH1A1HSD17B10 | |
| SCHEMBL6159010 | 0.68 | MEN1 (0.45) | CCKBRCCKARKDM4EALDH1A1HSD17B10 |
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-0715624-B1 | PROCESS FOR THE PREPARATION OF BENZODIAZEPINE COMPOUNDS USEFUL AS ANTAGONISTS OF CCK OR OF GASTRINE | YAMANOUCHI PHARMA CO LTD (JP) | 1998-04-08 | — | — | EP | disclosed |
| US-5728829-A | MULTISTAGE REACTION OF N-PROTECTED BENZOTRIAZOLYL GLYCINE DERIVATIVE WITH AMINOKETONE, THEN REACTION WITH AMMONIA AND ACID CATALYZED CYCLIZATION | FERRING-RESEARCH LIMITED (GB) | 1998-03-17 | — | — | US | disclosed |
| WO-1995006040-A1 | BENZODIAZEPINE COMPOUNDS USEFUL AS ANTAGONISTS OF CCK OR OF GASTRINE | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1995-03-02 | — | — | WO | disclosed |