Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 10/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | PRF1 | P14222 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3808243 | 0.81 | KCNJ1 (0.43) | KCNJ1PTGS2PTGS1KCNH2ACHE | |
| SCHEMBL14921946 | 0.77 | KCNJ1 (0.50) | KCNJ1PTGS2PTGS1KCNH2ACHE | |
| SCHEMBL2732045 | 0.77 | KCNJ1 (0.41) | KCNJ1PTGS2KCNH2ACHESSTR1 | |
| SCHEMBL29728674 | 0.76 | ESR1 (0.64) | KCNJ1ESR1ESR2KCNH2ACHE | |
| SCHEMBL286648 | 0.76 | ESR1 (0.64) | KCNJ1ESR1ESR2KCNH2ACHE | |
| SCHEMBL300145 | 0.76 | KCNJ1 (0.40) | KCNJ1KCNH2PRF1 | |
| SCHEMBL300308 | 0.76 | KCNJ1 (0.41) | KCNJ1KCNH2ACHESSTR1SLC6A4 | |
| SCHEMBL299969 | 0.75 | KCNJ1 (0.44) | KCNJ1KCNH2ACHESSTR1SLC6A4 | |
| SCHEMBL27262624 | 0.73 | KCNJ1 (0.44) | KCNJ1ESR1ESR2KCNH2ACHE | |
| SCHEMBL27094928 | 0.73 | KCNJ1 (0.44) | KCNJ1ESR1ESR2KCNH2ACHE |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2773351-A2 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | Merck Sharp & Dohme Corp. (US) | 2014-09-10 | — | — | EP | disclosed |
| WO-2013066718-A2 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | MERCK SHARP & DOHME CORP. (US) | 2013-05-10 | — | — | WO | disclosed |
| EP-2427444-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | Merck Sharp & Dohme Corp. (US) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010129379-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | MERCK SHARP & DOHME CORP. (US) | 2010-11-11 | — | — | WO | disclosed |