Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 14/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL286817 | 0.80 | KCNJ1 (0.58) | KCNJ1KCNH2ACHESSTR1SLC6A4 | |
| SCHEMBL30751813 | 0.80 | KCNJ1 (0.58) | KCNJ1KCNH2ACHESSTR1SLC6A4 | |
| SCHEMBL299969 | 0.80 | KCNJ1 (0.44) | KCNJ1KCNH2ACHESSTR1SLC6A4 | |
| SCHEMBL300175 | 0.77 | KCNJ1 (0.43) | KCNJ1KCNH2ACHESSTR1SLC6A4 | |
| SCHEMBL9517001 | 0.75 | AKR1B1 (0.43) | KCNJ1KCNH2AKR1B1PTGS2 | |
| SCHEMBL300308 | 0.75 | KCNJ1 (0.41) | KCNJ1KCNH2ACHESSTR1SLC6A4 | |
| SCHEMBL3808243 | 0.74 | KCNJ1 (0.43) | KCNJ1KCNH2ACHESSTR1SLC6A4 | |
| Hydrochloric Acid SCHEMBL2733903 | 0.71 | KCNJ1 (0.57) | KCNJ1KCNH2 | |
| SCHEMBL14921946 | 0.70 | KCNJ1 (0.50) | KCNJ1KCNH2ACHESSTR1SLC6A4 | |
| SCHEMBL300145 | 0.69 | KCNJ1 (0.40) | KCNJ1KCNH2 |
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-2632465-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | Merck Sharp & Dohme Corp. (US) | 2013-09-04 | — | — | EP | disclosed |
| WO-2012058116-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | MERCK SHARP & DOHME CORP. (US) | 2012-05-03 | — | — | WO | disclosed |