Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 17/20 | 0.71 |
| ▸ | KCNJ1 | P48048 | 16/20 | 0.71 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL4549575 | 0.87 | KCNH2 (0.93) | KCNH2KCNJ1SLC6A4 | |
| SCHEMBL2733634 | 0.83 | KCNH2 (1.00) | KCNH2KCNJ1SLC6A4 | |
| SCHEMBL4549630 | 0.82 | KCNH2 (1.00) | KCNH2KCNJ1SLC6A4 | |
| SCHEMBL4549555 | 0.81 | KCNH2 (0.93) | KCNH2KCNJ1SLC6A4 | |
| SCHEMBL2731436 | 0.79 | KCNJ1 (1.00) | KCNH2KCNJ1SLC6A4 | |
| SCHEMBL4549574 | 0.77 | KCNH2 (1.00) | KCNH2KCNJ1SLC6A4 | |
| SCHEMBL2732692 | 0.77 | KCNH2 (0.63) | KCNH2KCNJ1SLC6A4 | |
| SCHEMBL4549658 | 0.77 | KCNH2 (0.74) | KCNH2KCNJ1SLC6A4 | |
| SCHEMBL4549783 | 0.77 | KCNH2 (0.81) | KCNH2KCNJ1SLC6A4 | |
| SCHEMBL4549659 | 0.77 | KCNH2 (0.74) | KCNH2KCNJ1SLC6A4 |
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-2012058134-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | MERCK SHARP & DOHME CORP. (US) | 2012-05-03 | — | — | WO | disclosed |