Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 12/20 | 0.44 |
| ▸ | BACE1 | P56817 | 4/20 | 0.35 |
| ▸ | BACE2 | Q9Y5Z0 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPY1R | P25929 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9545585 | 0.90 | CCKBR (0.40) | CCKBRBACE1BACE2 | |
| SCHEMBL9545602 | 0.84 | CCKBR (0.42) | CCKBRBACE1BACE2 | |
| SCHEMBL9545572 | 0.83 | CCKBR (0.42) | CCKBRBACE1BACE2 | |
| SCHEMBL9545574 | 0.79 | CCKBR (0.43) | CCKBRBACE1BACE2 | |
| SCHEMBL9218194 | 0.76 | CCKBR (0.35) | CCKBRBACE1BACE2 | |
| SCHEMBL9213794 | 0.76 | BACE1 (0.35) | CCKBRBACE1BACE2 | |
| SCHEMBL9701161 | 0.74 | CCKBR (0.55) | CCKBRBACE1BACE2 | |
| SCHEMBL9702299 | 0.74 | CCKBR (0.55) | CCKBRBACE1BACE2 | |
| SCHEMBL9699964 | 0.74 | CCKBR (0.45) | CCKBRBACE1BACE2SMN1; SMN2NPY1R | |
| SCHEMBL9301937 | 0.74 | CCKBR (0.55) | CCKBRBACE1BACE2 |
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-1993019052-A1 | 3-UREIDO SUBSTITUTED BENZODIAZEPIN-2-ONES HAVING CHOLECYSTOKININ AND/OR GASTRIN ANTAGONISTIC ACTIVITY AND THEIR USE IN THERAPY | MERCK SHARP & DOHME LIMITED (GB) | 1993-09-30 | — | — | WO | claimed |
| WO-1993019052-A1 | 3-UREIDO SUBSTITUTED BENZODIAZEPIN-2-ONES HAVING CHOLECYSTOKININ AND/OR GASTRIN ANTAGONISTIC ACTIVITY AND THEIR USE IN THERAPY | MERCK SHARP & DOHME LIMITED (GB) | 1993-09-30 | — | — | WO | disclosed |