Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 2/20 | 0.43 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | GRM1 | Q13255 | 5/20 | 0.41 |
| ▸ | GRM5 | P41594 | 5/20 | 0.41 |
| ▸ | WNT3A | P56704 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | TNK2 | Q07912 | 2/20 | 0.41 |
| ▸ | BTK | Q06187 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 2/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28471545 | 0.86 | GRM1 (0.46) | TBK1PDK4GRM1GRM5WNT3A | |
| SCHEMBL26074128 | 0.86 | GRM5 (0.43) | TBK1PDK4GRM1GRM5WNT3A | |
| SCHEMBL30545737 | 0.86 | GRM5 (0.43) | TBK1PDK4GRM1GRM5WNT3A | |
| SCHEMBL31705477 | 0.84 | WNT3A (0.42) | TBK1NR1H2PDK4GRM1GRM5 | |
| SCHEMBL31704807 | 0.84 | WNT3A (0.42) | TBK1NR1H2PDK4GRM1GRM5 | |
| SCHEMBL24791833 | 0.84 | WNT3A (0.42) | TBK1PDK4GRM1GRM5WNT3A | |
| SCHEMBL609042 | 0.83 | NAMPT (0.44) | NR1H2PDK4GRM1GRM5NAMPT | |
| SCHEMBL29538449 | 0.83 | NAMPT (0.44) | NR1H2PDK4GRM1GRM5NAMPT | |
| SCHEMBL19992989 | 0.82 | GRM1 (0.56) | PDK4GRM1GRM5NAMPT | |
| SCHEMBL17002448 | 0.80 | NR1H2 (0.52) | NR1H2PDK4GRM1GRM5NAMPT |
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-114181257-A | Pyridine compound, pharmaceutical composition containing pyridine compound, preparation method and application of pyridine compound | 四川科伦博泰生物医药股份有限公司 | 2022-03-15 | — | — | CN | disclosed |