Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRS3 | P32247 | 2/20 | 0.41 |
| ▸ | ATP4A | P20648 | 9/20 | 0.41 |
| ▸ | ATP4B | P51164 | 9/20 | 0.41 |
| ▸ | ATP1A1 | P05023 | 6/20 | 0.41 |
| ▸ | ATP1B1 | P05026 | 6/20 | 0.41 |
| ▸ | ATP1A3 | P13637 | 6/20 | 0.41 |
| ▸ | ATP1B2 | P14415 | 6/20 | 0.41 |
| ▸ | ATP1A2 | P50993 | 6/20 | 0.41 |
| ▸ | ATP1B3 | P54709 | 6/20 | 0.41 |
| ▸ | FXYD2 | P54710 | 6/20 | 0.41 |
| ▸ | ATP1A4 | Q13733 | 6/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | WDR5 | P61964 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | DDAH1 | O94760 | 2/20 | 0.40 |
| ▸ | ENGASE | Q8NFI3 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9527196 | 0.92 | BRS3 (0.43) | BRS3ATP4AATP4BATP1A1ATP1B1 | |
| SCHEMBL23988599 | 0.92 | BRS3 (0.43) | BRS3ATP4AATP4BATP1A1ATP1B1 | |
| SCHEMBL23988275 | 0.92 | BRS3 (0.43) | BRS3ATP4AATP4BATP1A1ATP1B1 | |
| SCHEMBL9528700 | 0.90 | ATP4A (0.47) | BRS3ATP4AATP4BATP1A1ATP1B1 | |
| Esomeprazole SCHEMBL29673044 | 0.88 | BRS3 (0.52) | BRS3ATP4AATP4BATP1A1ATP1B1 | |
| Omeprazole SCHEMBL30179968 | 0.88 | BRS3 (0.52) | BRS3ATP4AATP4BATP1A1ATP1B1 | |
| Omeprazole SCHEMBL29538900 | 0.88 | BRS3 (0.52) | BRS3ATP4AATP4BATP1A1ATP1B1 | |
| Omeprazole SCHEMBL1191 | 0.88 | BRS3 (0.52) | BRS3ATP4AATP4BATP1A1ATP1B1 | |
| Omeprazole SCHEMBL82985 | 0.88 | BRS3 (0.52) | BRS3ATP4AATP4BATP1A1ATP1B1 | |
| Omeprazole SCHEMBL1560726 | 0.88 | BRS3 (0.52) | BRS3ATP4AATP4BATP1A1ATP1B1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0134400-B1 | FLUOROALKOXYSUBSTITUTED PYRIDYLMETHYLTHIO-(OR SULFINYL-)BENZIMIDAZOLES HAVING A SECRETOLYTIC ACTIVITY | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 1993-03-24 | — | — | EP | disclosed |