Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATP4A | P20648 | 8/20 | 0.42 |
| ▸ | ATP4B | P51164 | 8/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.42 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | FASN | P49327 | 1/20 | 0.42 |
| ▸ | SLC47A2 | Q86VL8 | 1/20 | 0.42 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.42 |
| ▸ | ATP1A1 | P05023 | 3/20 | 0.36 |
| ▸ | ATP1B1 | P05026 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7008228 | 0.94 | ATP4A (0.44) | ATP4AATP4BCYP2C9KDM4ESLC22A2 | |
| SCHEMBL7006711 | 0.93 | ATP4A (0.43) | ATP4AATP4BCYP2C9KDM4ESLC22A2 | |
| SCHEMBL14465119 | 0.93 | ATP4A (0.36) | ATP4AATP4BCYP2C9KDM4ESLC22A2 | |
| SCHEMBL7007925 | 0.93 | ATP4A (0.43) | ATP4AATP4BCYP2C9KDM4ESLC22A2 | |
| SCHEMBL7009441 | 0.93 | ATP4A (0.43) | ATP4AATP4BCYP2C9KDM4ESLC22A2 | |
| SCHEMBL7007909 | 0.92 | ATP4A (0.42) | ATP4AATP4BCYP2C9KDM4ESLC22A2 | |
| SCHEMBL12353527 | 0.92 | ATP4A (0.42) | ATP4AATP4BCYP2C9KDM4ESLC22A2 | |
| SCHEMBL7012531 | 0.92 | ATP4A (0.42) | ATP4AATP4BCYP2C9KDM4ESLC22A2 | |
| SCHEMBL5761564 | 0.92 | ATP4A (0.41) | ATP4AATP4BCYP2C9KDM4ESLC22A2 | |
| SCHEMBL2245635 | 0.92 | ATP4A (0.41) | ATP4AATP4BCYP2C9KDM4ESLC22A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007081871-A1 | THERAPEUTIC SALT COMPOSITIONS OF SULFONYL ESTER PRODRUGS OF PROTON PUMP INHIBITORS AND METHODS FOR THEIR PREPARATION | ALLERGAN, INC. (US) | 2007-07-19 | — | — | WO | disclosed |