Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 15/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8922602 | 1.00 | CCKBR (0.40) | CCKBRGRIN2BCHRNA7PKM | |
| SCHEMBL8922647 | 0.97 | CCKBR (0.42) | CCKBRGRIN2B | |
| SCHEMBL8922643 | 0.97 | CCKBR (0.42) | CCKBRGRIN2B | |
| SCHEMBL8921207 | 0.95 | GRIN2B (0.37) | CCKBRGRIN2BCHRNA7 | |
| SCHEMBL8921200 | 0.95 | GRIN2B (0.37) | CCKBRGRIN2BCHRNA7 | |
| SCHEMBL8919398 | 0.93 | GRIN2B (0.38) | CCKBRGRIN2B | |
| SCHEMBL8919393 | 0.93 | GRIN2B (0.38) | CCKBRGRIN2B | |
| SCHEMBL8922801 | 0.93 | CCKBR (0.46) | CCKBR | |
| SCHEMBL8922812 | 0.93 | CCKBR (0.46) | CCKBR | |
| SCHEMBL8922834 | 0.93 | CCKBR (0.41) | CCKBRGRIN2B |
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 2 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 |