Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1H | O95180 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 3/20 | 0.32 |
| ▸ | TGM2 | P21980 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18418129 | 0.82 | CACNA1H (0.38) | CACNA1HCYP2D6ALDH1A1SMN1; SMN2TGM2 | |
| SCHEMBL24534029 | 0.79 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2TGM2 | |
| SCHEMBL17714574 | 0.79 | USP2 (0.41) | SMN1; SMN2 | |
| SCHEMBL17318890 | 0.78 | TGM2 (0.35) | CACNA1HCYP2D6ALDH1A1SMN1; SMN2TGM2 | |
| SCHEMBL12492082 | 0.76 | CACNA1H (0.34) | CACNA1HCYP2D6 | |
| SCHEMBL22449838 | 0.76 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL22259417 | 0.76 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TGM2 | |
| SCHEMBL31616170 | 0.74 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL30869932 | 0.74 | USP2 (0.36) | SMN1; SMN2DRD2 | |
| SCHEMBL12492135 | 0.73 | SLC6A2 (0.34) | — |
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-3250204-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | Merck Sharp & Dohme Corp. (US) | 2017-12-06 | — | — | EP | disclosed |
| EP-3212616-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | Merck Sharp & Dohme Corp. (US) | 2017-09-06 | — | — | EP | disclosed |
| WO-2016122994-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | MERCK SHARP & DOHME CORP. (US) | 2016-08-04 | — | — | WO | disclosed |
| WO-2016069430-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | MERCK SHARP & DOHME CORP. (US) | 2016-05-06 | — | — | WO | disclosed |