Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 2/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.46 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29394845 | 0.87 | PDE4A (0.56) | PDCD1CD274PDE4APDE4BPDE4C | |
| SCHEMBL28297926 | 0.84 | PDE4A (0.46) | PDE4APDE4BPDE4CPDE4DGAA | |
| SCHEMBL28297921 | 0.80 | PDE4A (0.46) | PDE4APDE4BPDE4CPDE4DGAA | |
| SCHEMBL29395562 | 0.77 | PDE4A (0.60) | PDE4APDE4BPDE4CPDE4DGAA | |
| SCHEMBL14559416 | 0.75 | CD274 (0.68) | PDCD1CD274PDE4APDE4BPDE4C | |
| SCHEMBL17504234 | 0.74 | MTOR (0.47) | MTORPOLBMAPTHPGDSKDM4E | |
| SCHEMBL19642636 | 0.73 | BCHE (0.41) | PDCD1CD274PDE4APDE4BPDE4C | |
| SCHEMBL29394932 | 0.72 | CA12 (0.68) | PDCD1CD274PDE4APDE4BPDE4C | |
| SCHEMBL11405171 | 0.72 | GAA (0.53) | PDE4APDE4BPDE4CPDE4DGAA | |
| SCHEMBL6014889 | 0.72 | CA12 (0.71) | PDCD1CD274PDE4APDE4BPDE4C |
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 |
|---|---|---|---|---|---|---|---|
| CN-109863140-A | 3- oxo -2,6- diphenyl -2,3- dihydrogen dazin -4- formamide | 拜耳医药股份有限公司 | 2019-06-07 | — | — | CN | disclosed |