Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.34 |
| ▸ | KCNJ1 | P48048 | 6/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 4/20 | 0.30 |
| ▸ | HTR1D | P28221 | 4/20 | 0.30 |
| ▸ | HTR1A | P08908 | 3/20 | 0.30 |
| ▸ | DRD4 | P21917 | 2/20 | 0.30 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2898321 | 0.87 | HTR2A (0.41) | HTR2AKCNJ1KCNH2DRD2HTR1D | |
| SCHEMBL299763 | 0.80 | HTR2A (0.45) | HTR2AKCNJ1KCNH2CA1CA2 | |
| SCHEMBL13028045 | 0.79 | HTR2A (0.35) | HTR2AKCNJ1KCNH2DRD2HTR1D | |
| SCHEMBL300052 | 0.75 | GPR119 (0.40) | KCNJ1KCNH2 | |
| SCHEMBL287130 | 0.73 | KCNJ1 (0.34) | HTR2AKCNJ1HTR1DHTR1A | |
| SCHEMBL2894905 | 0.73 | MEN1 (0.35) | HTR2AKCNJ1KCNH2DRD2HTR1D | |
| SCHEMBL296779 | 0.70 | MTNR1A (0.40) | HTR2ADRD2HTR1DHTR1ADRD4 | |
| SCHEMBL2895014 | 0.69 | KCNJ1 (0.69) | KCNJ1KCNH2 | |
| SCHEMBL4606848 | 0.69 | BCHE (0.42) | — | |
| SCHEMBL10993273 | 0.68 | KCNN2 (0.44) | — |
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-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 |