Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.58 |
| ▸ | HTR1B | P28222 | 5/20 | 0.50 |
| ▸ | HTR1D | P28221 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | HTR7 | P34969 | 2/20 | 0.44 |
| ▸ | HTR6 | P50406 | 2/20 | 0.44 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4776890 | 0.85 | HTR1A (0.56) | HTR1A | |
| SCHEMBL4725722 | 0.84 | HTR1A (0.56) | HTR1A | |
| SCHEMBL4776817 | 0.84 | HTR1A (0.56) | HTR1A | |
| SCHEMBL4861936 | 0.82 | DRD2 (0.54) | HTR1AKMT2AMEN1 | |
| SCHEMBL5745448 | 0.81 | GAA (0.43) | KMT2AMEN1 | |
| SCHEMBL4725531 | 0.78 | TDP1 (0.40) | HTR1BKMT2ATDP1HRH3HTR2A | |
| SCHEMBL23067892 | 0.74 | HTR1B (0.84) | HTR1AHTR1BHTR1DKMT2ASLC6A4 | |
| SCHEMBL30756665 | 0.74 | HTR1B (0.84) | HTR1AHTR1BHTR1DKMT2ASLC6A4 | |
| SCHEMBL5769753 | 0.74 | HTR1A (0.98) | HTR1A | |
| SCHEMBL9762578 | 0.71 | HTR1B (0.78) | HTR1AHTR1BHTR1DKMT2ASLC6A4 |
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-1544201-B1 | NOVEL DERIVATIVES OF CYCLOALCANODIONES, METHOD FOR THE PRODUCTION THEREOF AND THEIR PHARMACOLOGICAL APPLICATIONS | CEPA SCHWARZ PHARMA S L (ES) | 2006-06-28 | — | — | EP | claimed |
| WO-2008015538-A2 | USE OF DIAZA- AND THIAZA-CYCLOALKANEDIONES FOR PREVENTING AND/OR TREATING PAIN AND /OR MIGRAINE | SCHWARZ PHARMA S.L. (ES) | 2008-02-07 | — | — | WO | disclosed |