Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 7/20 | 0.34 |
| ▸ | HTR2C | P28335 | 5/20 | 0.34 |
| ▸ | HTR2B | P41595 | 5/20 | 0.34 |
| ▸ | HTR1A | P08908 | 3/20 | 0.33 |
| ▸ | DRD2 | P14416 | 3/20 | 0.33 |
| ▸ | HTR1D | P28221 | 3/20 | 0.33 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL296779 | 0.92 | MTNR1A (0.40) | CYP19A1MTNR1AMTNR1BHTR2AHTR2C | |
| SCHEMBL297766 | 0.84 | HTR2C (0.46) | CYP19A1MTNR1AMTNR1BHTR2AHTR2C | |
| SCHEMBL2898778 | 0.83 | MEN1 (0.38) | MTNR1AMTNR1BHTR2AHTR1ADRD2 | |
| SCHEMBL286987 | 0.79 | MTNR1B (0.40) | MTNR1AMTNR1BHTR2AHTR1ADRD2 | |
| SCHEMBL4606848 | 0.77 | BCHE (0.42) | HTT | |
| SCHEMBL2898321 | 0.75 | HTR2A (0.41) | HTR2AHTR1ADRD2HTR1DDRD4 | |
| SCHEMBL7289317 | 0.75 | MAOA (0.42) | — | |
| SCHEMBL10993273 | 0.73 | KCNN2 (0.44) | — | |
| SCHEMBL299486 | 0.73 | KCNJ1 (0.38) | HTR2AHTR2BHTR1ADRD2HTR1D | |
| SCHEMBL7291340 | 0.72 | BCHE (0.50) | DRD4 |
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 |