Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 14/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPY1R | P25929 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8903048 | 1.00 | CCKBR (0.62) | CCKBRALDH1A1MAPTCASP1MEN1 | |
| SCHEMBL8903044 | 1.00 | CCKBR (0.62) | CCKBRALDH1A1MAPTCASP1MEN1 | |
| SCHEMBL8904459 | 0.92 | CCKBR (0.62) | CCKBRALDH1A1MAPTCASP1MEN1 | |
| SCHEMBL8904296 | 0.90 | CCKBR (0.60) | CCKBR | |
| SCHEMBL8903101 | 0.90 | CCKBR (0.60) | CCKBR | |
| SCHEMBL8903106 | 0.90 | CCKBR (0.60) | CCKBR | |
| SCHEMBL8903311 | 0.90 | CCKBR (0.51) | CCKBR | |
| SCHEMBL8903172 | 0.90 | CCKBR (0.51) | CCKBR | |
| SCHEMBL8904898 | 0.86 | CCKBR (0.63) | CCKBRALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL8904274 | 0.84 | CCKBR (0.60) | CCKBRALDH1A1MAPT |
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-5618808-A | Benzothiazepine and benzoxazepine derivatives as cholecystokinin receptor antagonists | PFIZER, INC. (US) | 1997-04-08 | — | — | US | disclosed |