Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 4/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | MAOA | P21397 | 4/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3393091 | 0.81 | PYCR1 (0.67) | PYCR1TSHRSLC6A4MAOBMAOA | |
| SCHEMBL12963728 | 0.78 | TSHR (0.53) | HRH3TSHRSLC6A4SLC6A3 | |
| SCHEMBL13070308 | 0.77 | PRMT6 (0.51) | TSHRSLC6A4SLC6A3 | |
| SCHEMBL3393368 | 0.75 | PYCR1 (0.59) | PYCR1TSHRSLC6A4SLC6A3MAOB | |
| SCHEMBL3396909 | 0.75 | SLC6A4 (0.56) | PYCR1SLC6A4SLC6A3MAOBMAOA | |
| SCHEMBL27210386 | 0.75 | PYCR1 (0.72) | PYCR1MAOBMAOA | |
| SCHEMBL17914547 | 0.74 | TSHR (0.46) | HRH3TSHRSLC6A4SLC6A3 | |
| SCHEMBL14376823 | 0.74 | SLC6A4 (0.50) | HRH3TSHRSLC6A4SLC6A3 | |
| SCHEMBL3397214 | 0.73 | PYCR1 (0.41) | PYCR1TSHRSLC6A4 | |
| SCHEMBL14376814 | 0.72 | SLC6A4 (0.48) | TSHRSLC6A4SLC6A3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2246329-A1 | 4(1H)-pyridinone derivatives and their use as antimalaria agents | Glaxo Group Limited (GB) | 2010-11-03 | — | — | EP | disclosed |