Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.60 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.60 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.60 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.60 |
| ▸ | KCND3 | Q9UK17 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL1602894 | 1.00 | ABCB1 (0.60) | ABCB1KCNE1KCNQ1KCNH2SCN5A | |
| SCHEMBL1602592 | 0.94 | ABCB1 (0.65) | ABCB1KCNE1KCNQ1KCNH2SCN5A | |
| SCHEMBL12709255 | 0.94 | ABCB1 (0.65) | ABCB1KCNE1KCNQ1KCNH2SCN5A | |
| SCHEMBL1602591 | 0.94 | ABCB1 (0.65) | ABCB1KCNE1KCNQ1KCNH2SCN5A | |
| SCHEMBL5107215 | 0.94 | ABCB1 (0.65) | ABCB1KCNE1KCNQ1KCNH2SCN5A | |
| SCHEMBL12709185 | 0.94 | ABCB1 (0.65) | ABCB1KCNE1KCNQ1KCNH2SCN5A | |
| SCHEMBL12709304 | 0.93 | ABCB1 (0.66) | ABCB1KCNE1KCNQ1KCNH2SCN5A | |
| SCHEMBL12735019 | 0.93 | ABCB1 (0.66) | ABCB1KCNE1KCNQ1KCNH2SCN5A | |
| SCHEMBL14051499 | 0.93 | ABCB1 (0.66) | ABCB1KCNE1KCNQ1KCNH2SCN5A | |
| SCHEMBL14032747 | 0.93 | ABCB1 (0.66) | ABCB1KCNE1KCNQ1KCNH2SCN5A |
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 |
|---|---|---|---|---|---|---|---|
| US-7919523-B2 | Inhibitors of aspartyl protease | VERTEX PHARMACEUTICALS, INC. (US) | 2011-04-05 | — | — | US | disclosed |