Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 7/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | AMPD2 | Q01433 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8922827 | 0.89 | CCKBR (0.47) | CCKBRCYP2C19SIGMAR1RAB9ASLC6A2 | |
| SCHEMBL8919181 | 0.86 | CCKBR (0.63) | CCKBR | |
| SCHEMBL8920848 | 0.82 | CYP2C19 (0.47) | CCKBRCYP2C19SIGMAR1RAB9AKMT2A | |
| SCHEMBL8398546 | 0.81 | CCKBR (0.48) | CCKBR | |
| SCHEMBL9544058 | 0.79 | CCKBR (0.47) | CCKBRCYP2C19SIGMAR1AADATKMT2A | |
| SCHEMBL9541664 | 0.79 | CCKBR (0.48) | CCKBRCYP2C19 | |
| SCHEMBL9541509 | 0.78 | CCKBR (0.68) | CCKBR | |
| SCHEMBL8402157 | 0.78 | CCKBR (0.50) | CCKBRCYP2C19SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9543807 | 0.76 | CCKBR (0.80) | CCKBR | |
| SCHEMBL8398551 | 0.76 | CYP2C19 (0.41) | CCKBRCYP2C19AADATTSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993015059-A1 | 3-PHENYLUREIDO-AZEPIN-2-ONES AND -BENZAZEPIN-2-ONES USEFUL AS CHOLECYSTOKININ ANTAGONISTS | PFIZER INC. (US) | 1993-08-05 | — | — | WO | disclosed |