Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 5/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.42 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | SPR | P35270 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23144511 | 0.82 | HSD11B1 (0.44) | GRM5HSD11B1ALDH1A1LMNACYP3A4 | |
| SCHEMBL8904306 | 0.81 | ALDH1A1 (0.47) | GRM5ALDH1A1LMNACYP3A4CYP2D6 | |
| SCHEMBL8903739 | 0.81 | GRM5 (0.50) | GRM5HSD11B1ALDH1A1PDCD1CD274 | |
| SCHEMBL5326103 | 0.80 | ALDH1A1 (0.47) | HSD11B1ALDH1A1LMNACYP3A4CYP2D6 | |
| SCHEMBL8904586 | 0.79 | GRM5 (0.53) | GRM5HSD11B1PDCD1CD274CYP3A4 | |
| SCHEMBL8904921 | 0.78 | ALDH1A1 (0.46) | GRM5HSD11B1ALDH1A1LMNACYP2D6 | |
| SCHEMBL23144924 | 0.78 | ALDH1A1 (0.41) | GRM5HSD11B1ALDH1A1LMNAPDCD1 | |
| SCHEMBL21138876 | 0.78 | GRM5 (0.55) | GRM5HSD11B1ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL23145181 | 0.77 | HPGD (0.42) | ALDH1A1LMNACYP3A4CYP2D6TSHR | |
| SCHEMBL23144562 | 0.77 | ALDH1A1 (0.44) | GRM5HSD11B1ALDH1A1LMNAPOLB |
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-5618808-A | Benzothiazepine and benzoxazepine derivatives as cholecystokinin receptor antagonists | PFIZER, INC. (US) | 1997-04-08 | — | — | US | disclosed |
| EP-0648213-A1 | BENZOTHIAZEPINE AND BENZOXAZEPINE DERIVATIVES AS CHOLECYSTOKININ RECEPTOR ANTAGONISTS | PFIZER INC. (US) | 1995-04-19 | — | — | EP | disclosed |
| WO-1994001421-A1 | BENZOTHIAZEPINE AND BENZOXAZEPINE DERIVATIVES AS CHOLECYSTOKININ RECEPTOR ANTAGONISTS | PFIZER INC. (US) | 1994-01-20 | — | — | WO | disclosed |