Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRS3 | P32247 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.39 |
| ▸ | WDR5 | P61964 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | DDAH1 | O94760 | 2/20 | 0.38 |
| ▸ | ENGASE | Q8NFI3 | 2/20 | 0.38 |
| ▸ | ATP1A1 | P05023 | 2/20 | 0.38 |
| ▸ | ATP1B1 | P05026 | 2/20 | 0.38 |
| ▸ | ATP1A3 | P13637 | 2/20 | 0.38 |
| ▸ | ATP1B2 | P14415 | 2/20 | 0.38 |
| ▸ | ATP4A | P20648 | 2/20 | 0.38 |
| ▸ | ATP1A2 | P50993 | 2/20 | 0.38 |
| ▸ | ATP4B | P51164 | 2/20 | 0.38 |
| ▸ | ATP1B3 | P54709 | 2/20 | 0.38 |
| ▸ | FXYD2 | P54710 | 2/20 | 0.38 |
| ▸ | ATP1A4 | Q13733 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL5363676 | 0.88 | BRS3 (0.52) | BRS3CYP2C9SHMT2WDR5KMT2A | |
| SCHEMBL6505209 | 0.86 | BRS3 (0.50) | BRS3CYP2C9SHMT2WDR5KMT2A | |
| SCHEMBL5358476 | 0.82 | BRS3 (0.49) | BRS3CYP2C9SHMT2WDR5KMT2A | |
| SCHEMBL5730609 | 0.81 | CYP2C9 (0.44) | BRS3CYP2C9WDR5KMT2ADDAH1 | |
| SCHEMBL5764036 | 0.81 | CYP2C9 (0.40) | BRS3CYP2C9WDR5KMT2ADDAH1 | |
| SCHEMBL5367604 | 0.81 | BRS3 (0.51) | BRS3CYP2C9SHMT2WDR5KMT2A | |
| SCHEMBL5367213 | 0.80 | BRS3 (0.44) | BRS3CYP2C9WDR5KMT2ADDAH1 | |
| SCHEMBL5446484 | 0.79 | BRS3 (0.49) | BRS3CYP2C9SHMT2WDR5KMT2A | |
| SCHEMBL5369638 | 0.77 | BRS3 (0.43) | BRS3CYP2C9SHMT2WDR5KMT2A | |
| SCHEMBL5364325 | 0.75 | BRS3 (0.42) | BRS3CYP2C9SHMT2KMT2AHPGD |
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 |