Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 10/20 | 0.57 |
| ▸ | CYSLTR1 | Q9Y271 | 5/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.41 |
| ▸ | PPARG | P37231 | 3/20 | 0.41 |
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | XPO1 | O14980 | 1/20 | 0.37 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.37 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RARB | P10826 | 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 | |
|---|---|---|---|---|
| SCHEMBL9302356 | 0.92 | CCKBR (0.48) | CCKBRCYSLTR1EPHX2PPARGCYSLTR2 | |
| SCHEMBL9303126 | 0.90 | CCKBR (0.55) | CCKBRCYSLTR1EPHX2PPARGEGFR | |
| SCHEMBL9301937 | 0.90 | CCKBR (0.55) | CCKBRCYSLTR1EPHX2PPARGEGFR | |
| SCHEMBL9303570 | 0.90 | CCKBR (0.45) | CCKBRCYSLTR1EPHX2PPARGCYSLTR2 | |
| SCHEMBL9701161 | 0.87 | CCKBR (0.55) | CCKBRCCKARBACE1BACE2 | |
| SCHEMBL9702299 | 0.87 | CCKBR (0.55) | CCKBRCCKARBACE1BACE2 | |
| SCHEMBL9301948 | 0.81 | CCKBR (0.41) | CCKBRNPC1RAB9ACCKARBACE1 | |
| SCHEMBL9699964 | 0.80 | CCKBR (0.45) | CCKBRMAPTMAPK1TP53HTT | |
| SCHEMBL9699961 | 0.80 | CCKBR (0.45) | CCKBRMAPTMAPK1TP53HTT | |
| SCHEMBL9218194 | 0.75 | CCKBR (0.35) | CCKBRCCKARBACE1BACE2 |
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-0514133-A1 | Benzodiazepine derivatives, compositions containing them and their use in therapy | MERCK SHARP & DOHME LTD. (GB) | 1992-11-19 | — | — | EP | claimed |
| US-5360802-A | Antagonists of cholecystokinin and gastrin | MERCK SHARPE & DOHME LTD. | 1994-11-01 | — | — | US | disclosed |
| EP-0514133-A1 | Benzodiazepine derivatives, compositions containing them and their use in therapy | MERCK SHARP & DOHME LTD. (GB) | 1992-11-19 | — | — | EP | disclosed |