Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 5/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.51 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.42 |
| ▸ | SCN1A | P35498 | 3/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.42 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.42 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.42 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.42 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
| ▸ | KCND3 | Q9UK17 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1807175 | 0.89 | KCNA5 (0.51) | KCNA5KCNH2CYP2D6KCNE1CYP1A2 | |
| SCHEMBL7448738 | 0.88 | KCNA5 (0.50) | KCNA5KCNH2CYP2D6KCNE1CYP1A2 | |
| SCHEMBL7449955 | 0.86 | KCNA5 (0.49) | KCNA5KCNH2CYP2D6KCNE1CYP1A2 | |
| SCHEMBL7452991 | 0.86 | KCNA5 (0.49) | KCNA5KCNH2CYP2D6KCNE1CYP1A2 | |
| SCHEMBL7449942 | 0.85 | TSHR (0.49) | KCNA5KCNH2CYP2D6KCNE1CYP1A2 | |
| SCHEMBL7445416 | 0.85 | KCNA5 (0.53) | KCNA5KCNH2CYP2D6KCNE1CYP1A2 | |
| SCHEMBL6706897 | 0.82 | KCNA5 (0.47) | KCNA5KCNH2CYP2D6KCNE1CYP1A2 | |
| SCHEMBL21742012 | 0.80 | KCNA5 (0.49) | KCNA5KCNH2CYP2D6KCNE1CYP1A2 | |
| SCHEMBL23969993 | 0.79 | KCNH2 (0.55) | KCNA5KCNH2CYP2D6KCNE1CYP1A2 | |
| SCHEMBL2957267 | 0.79 | TSHR (0.58) | KCNA5KCNH2CYP2D6KCNE1CYP1A2 |
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-0977743-A1 | PROTEASE INHIBITORS | Smithkline Beecham (US) | 2000-02-09 | — | — | EP | disclosed |
| WO-1998049152-A1 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1998-11-05 | — | — | WO | disclosed |