Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 15/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8401370 | 0.91 | CCKBR (0.48) | CCKBR | |
| SCHEMBL9544058 | 0.89 | CCKBR (0.47) | CCKBRMEN1ALDH1A1KMT2ASIGMAR1 | |
| SCHEMBL8920561 | 0.87 | CCKBR (0.49) | CCKBRMEN1KMT2ACYP2C19 | |
| SCHEMBL8919363 | 0.87 | CCKBR (0.48) | CCKBRSIGMAR1CYP2C19 | |
| SCHEMBL9366810 | 0.86 | CYP2C19 (0.47) | CCKBRKMT2ASIGMAR1CYP2C19 | |
| SCHEMBL8912603 | 0.84 | CCKBR (0.46) | CCKBR | |
| SCHEMBL8399132 | 0.81 | CCKBR (0.50) | CCKBRSIGMAR1CYP2C19 | |
| SCHEMBL8398546 | 0.80 | CCKBR (0.48) | CCKBR | |
| SCHEMBL8402240 | 0.80 | CYP2C19 (0.41) | CCKBRMEN1ALDH1A1KMT2ACYP2C19 | |
| SCHEMBL8922827 | 0.79 | CCKBR (0.47) | CCKBRMEN1ALDH1A1KMT2ASIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5643904-A | Substituted hexahdryoazepinones and tetrahydrobenzazepinones | PFIZER INC. (US) | 1997-07-01 | — | — | US | disclosed |
| US-5484917-A | FOR TREATMENT AND PREVENTION OF GASTROINTESTINAL DISORDERS, PAIN AND ANXIETY | PFIZER INC. (US) | 1996-01-16 | — | — | US | disclosed |
| WO-1993015059-A1 | 3-PHENYLUREIDO-AZEPIN-2-ONES AND -BENZAZEPIN-2-ONES USEFUL AS CHOLECYSTOKININ ANTAGONISTS | PFIZER INC. (US) | 1993-08-05 | — | — | WO | disclosed |