Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 10/20 | 0.51 |
| ▸ | CCKAR | P32238 | 8/20 | 0.49 |
| ▸ | IDO1 | P14902 | 4/20 | 0.45 |
| ▸ | TDO2 | P48775 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7544237 | 1.00 | CCKBR (0.51) | CCKBRCCKARIDO1TDO2 | |
| SCHEMBL6302368 | 1.00 | CCKBR (0.51) | CCKBRCCKARIDO1TDO2 | |
| SCHEMBL7548748 | 0.86 | NOTCH1 (0.44) | CCKBR | |
| SCHEMBL7548754 | 0.86 | NOTCH1 (0.44) | CCKBR | |
| SCHEMBL7546575 | 0.86 | CCKBR (0.53) | CCKBRCCKARIDO1TDO2 | |
| SCHEMBL9248094 | 0.86 | CCKBR (0.53) | CCKBRCCKARIDO1TDO2 | |
| SCHEMBL6005277 | 0.86 | CCKBR (0.53) | CCKBRCCKARIDO1TDO2 | |
| SCHEMBL7552385 | 0.86 | CCKBR (0.49) | CCKBRCCKARIDO1TDO2 | |
| SCHEMBL7552389 | 0.86 | CCKBR (0.49) | CCKBRCCKARIDO1TDO2 | |
| SCHEMBL7552319 | 0.84 | CCKBR (0.52) | CCKBRCCKARIDO1TDO2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5451582-A | Cholecystokinins and gastrin receptor antagonists | MERCK SHARP & DOHME LTD. (GB) | 1995-09-19 | — | — | US | disclosed |