Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30189372 | 0.87 | MAPT (0.44) | SMN1; SMN2CYP1A2CYP3A4ALDH1A1NPSR1 | |
| SCHEMBL30189336 | 0.84 | LMNA (0.41) | CYP1A2CYP3A4NPSR1LMNAMAOA | |
| SCHEMBL22886451 | 0.84 | LMNA (0.41) | CYP1A2CYP3A4NPSR1LMNAMAOA | |
| SCHEMBL1144240 | 0.84 | MAPT (0.46) | SMN1; SMN2POLBCYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL1144241 | 0.84 | MAPT (0.46) | SMN1; SMN2POLBCYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL20028730 | 0.84 | MAPT (0.47) | SMN1; SMN2CYP1A2CYP3A4ALDH1A1NPSR1 | |
| SCHEMBL30189419 | 0.84 | MAPT (0.47) | SMN1; SMN2CYP1A2CYP3A4ALDH1A1NPSR1 | |
| SCHEMBL3268819 | 0.83 | SMN1; SMN2 (0.55) | SMN1; SMN2ABCC1POLBCYP1A2CYP3A4 | |
| SCHEMBL1144606 | 0.83 | MAPT (0.50) | SMN1; SMN2TSHRALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL1144604 | 0.83 | MAPT (0.50) | SMN1; SMN2TSHRALDH1A1NPSR1L3MBTL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115636782-B | Synthesis method of polyaryl substituted pyridine | 浙江工业大学 | 2024-07-19 | — | — | CN | disclosed |
| CN-115636782-A | Synthetic method of polyaryl substituted pyridine | 浙江工业大学 | 2023-01-24 | — | — | CN | disclosed |
| CN-113444037-A | Green synthesis method of nicotinic acid ester compound based on nonmetal condition | 安阳师范学院 | 2021-09-28 | — | — | CN | disclosed |