Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.38 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL23144745 | 0.87 | ALDH1A1 (0.47) | ALDH1A1LMNASMN1; SMN2HTTPOLB | |
| SCHEMBL16621801 | 0.82 | ALDH1A1 (0.52) | ALDH1A1LMNASMN1; SMN2POLBMEN1 | |
| SCHEMBL11837217 | 0.81 | ALDH1A1 (0.52) | ALDH1A1LMNASMN1; SMN2HTTPOLB | |
| SCHEMBL8905402 | 0.81 | GRM5 (0.50) | ALDH1A1LMNASMN1; SMN2HTTPOLB | |
| SCHEMBL8903212 | 0.81 | ALDH1A1 (0.40) | ALDH1A1LMNASMN1; SMN2HTTPOLB | |
| SCHEMBL229165 | 0.81 | ALDH1A1 (0.41) | ALDH1A1LMNASMN1; SMN2HTTPOLB | |
| SCHEMBL8669350 | 0.81 | ALDH1A1 (0.40) | ALDH1A1LMNASMN1; SMN2HTTPOLB | |
| SCHEMBL23144562 | 0.80 | ALDH1A1 (0.44) | ALDH1A1LMNASMN1; SMN2HTTPOLB | |
| SCHEMBL11892718 | 0.79 | L3MBTL1 (0.47) | ALDH1A1SMN1; SMN2POLBMEN1CYP2C9 | |
| SCHEMBL9155855 | 0.79 | KMT2A (0.39) | ALDH1A1LMNASMN1; SMN2HTTPOLB |
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 |