Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | ATP4A | P20648 | 5/20 | 0.39 |
| ▸ | ATP4B | P51164 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | WDR5 | P61964 | 3/20 | 0.39 |
| ▸ | BRS3 | P32247 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | ATP1A1 | P05023 | 2/20 | 0.39 |
| ▸ | ATP1B1 | P05026 | 2/20 | 0.39 |
| ▸ | ATP1A3 | P13637 | 2/20 | 0.39 |
| ▸ | ATP1B2 | P14415 | 2/20 | 0.39 |
| ▸ | ATP1A2 | P50993 | 2/20 | 0.39 |
| ▸ | ATP1B3 | P54709 | 2/20 | 0.39 |
| ▸ | FXYD2 | P54710 | 2/20 | 0.39 |
| ▸ | ATP1A4 | Q13733 | 2/20 | 0.39 |
| ▸ | DDAH1 | O94760 | 2/20 | 0.39 |
| ▸ | ENGASE | Q8NFI3 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5320866 | 0.74 | CYP2C9 (0.40) | CYP2C9ATP4AATP4BKMT2AWDR5 | |
| SCHEMBL9704226 | 0.69 | BRS3 (0.46) | CYP2C9ATP4AATP4BKMT2AWDR5 | |
| SCHEMBL3799564 | 0.66 | AGXT (0.57) | CYP2C9ATP4AATP4BKMT2AWDR5 | |
| SCHEMBL5331906 | 0.64 | CYP2C9 (0.45) | CYP2C9ATP4AATP4BKMT2AWDR5 | |
| SCHEMBL5339698 | 0.64 | CYP2C9 (0.43) | CYP2C9ATP4AATP4BKMT2AWDR5 | |
| Omeprazole Sulfone SCHEMBL29415504 | 0.64 | CYP2C9 (0.85) | CYP2C9ATP4AATP4BKMT2AWDR5 | |
| Omeprazole Sulfone SCHEMBL2340649 | 0.64 | CYP2C9 (0.85) | CYP2C9ATP4AATP4BKMT2AWDR5 | |
| Omeprazole Sulfone SCHEMBL33721996 | 0.64 | CYP2C9 (0.85) | CYP2C9ATP4AATP4BKMT2AWDR5 | |
| Omeprazole Sulfone SCHEMBL4950986 | 0.64 | CYP2C9 (1.00) | CYP2C9ATP4AATP4BKMT2AWDR5 | |
| SCHEMBL25476488 | 0.63 | BRS3 (0.53) | CYP2C9ATP4AATP4BKMT2AWDR5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1644352-A1 | PROCESS FOR PREPARING ISOMERICALLY PURE PRODRUGS OF PROTON PUMP INHIBITORS | Allergan, Inc. (US) | 2006-04-12 | — | — | EP | disclosed |
| WO-2005016917-A1 | PROCESS FOR PREPARING ISOMERICALLY PURE PRODRUGS OF PROTON PUMP INHIBITORS | ALLERGAN, INC. (US) | 2005-02-24 | — | — | WO | disclosed |