Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 14/20 | 0.55 |
| ▸ | BACE1 | P56817 | 4/20 | 0.37 |
| ▸ | BACE2 | Q9Y5Z0 | 4/20 | 0.37 |
| ▸ | CCKAR | P32238 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9701161 | 1.00 | CCKBR (0.55) | CCKBRBACE1BACE2CCKARPKM | |
| SCHEMBL9301937 | 0.89 | CCKBR (0.55) | CCKBRBACE1BACE2CCKAR | |
| SCHEMBL9303126 | 0.89 | CCKBR (0.55) | CCKBRBACE1BACE2CCKAR | |
| SCHEMBL9301587 | 0.87 | CCKBR (0.57) | CCKBRBACE1BACE2CCKAR | |
| SCHEMBL9302356 | 0.87 | CCKBR (0.48) | CCKBRBACE1BACE2CCKAR | |
| SCHEMBL9699964 | 0.83 | CCKBR (0.45) | CCKBRBACE1BACE2 | |
| SCHEMBL9699961 | 0.83 | CCKBR (0.45) | CCKBRBACE1BACE2 | |
| SCHEMBL9301948 | 0.79 | CCKBR (0.41) | CCKBRBACE1BACE2CCKAR | |
| SCHEMBL9303570 | 0.77 | CCKBR (0.45) | CCKBR | |
| SCHEMBL9545585 | 0.76 | CCKBR (0.40) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0514133-A1 | Benzodiazepine derivatives, compositions containing them and their use in therapy | MERCK SHARP & DOHME LTD. (GB) | 1992-11-19 | — | — | EP | claimed |