Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 18/20 | 0.67 |
| ▸ | MAOB | P27338 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | MAOA | P21397 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | BLM | P54132 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3393368 | 0.85 | PYCR1 (0.59) | PYCR1MAOBTSHRALDH1A1SLC6A4 | |
| SCHEMBL3396909 | 0.85 | SLC6A4 (0.56) | PYCR1MAOBMAOAALDH1A1SLC6A4 | |
| SCHEMBL13074386 | 0.85 | SLC6A4 (0.57) | PYCR1TSHRALDH1A1SLC6A4 | |
| SCHEMBL3394463 | 0.81 | PYCR1 (0.47) | PYCR1MAOBTSHRMAOASLC6A4 | |
| SCHEMBL3394172 | 0.79 | PYCR1 (1.00) | PYCR1MAOBLMNAUSP2CYP3A4 | |
| SCHEMBL8244727 | 0.78 | PYCR1 (0.72) | PYCR1MAOBLMNAUSP2CYP3A4 | |
| SCHEMBL2056224 | 0.78 | SLC6A4 (0.66) | TSHRALDH1A1SLC6A4 | |
| SCHEMBL13070308 | 0.78 | PRMT6 (0.51) | TSHRALDH1A1SLC6A4 | |
| SCHEMBL3423840 | 0.78 | SLC6A4 (0.50) | PYCR1MAOBTSHRALDH1A1SLC6A4 | |
| SCHEMBL13070333 | 0.78 | SLC6A4 (0.50) | PYCR1MAOBTSHRALDH1A1SLC6A4 |
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 |