Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.41 |
| ▸ | PDE2A | O00408 | 6/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.39 |
| ▸ | CETP | P11597 | 1/20 | 0.39 |
| ▸ | PTPRA | P18433 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | PDE1A | P54750 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29067188 | 0.83 | NPC1 (0.48) | MEN1KMT2AGRIN1GRIN2BGRIN2D | |
| SCHEMBL29067191 | 0.82 | NPC1 (0.44) | KMT2AGRIN1GRIN2BGRIN2DGRIN3B | |
| SCHEMBL29067198 | 0.80 | GRIN2D (0.45) | MEN1KMT2AGRIN1GRIN2BGRIN2D | |
| SCHEMBL29067199 | 0.79 | GRIN2D (0.46) | MEN1KMT2AGRIN1GRIN2BGRIN2D | |
| SCHEMBL29067184 | 0.78 | ALDH1A1 (0.49) | MEN1KMT2AGRIN1GRIN2BGRIN2D | |
| SCHEMBL20032388 | 0.78 | PDE2A (0.53) | PDE2AEPHX2 | |
| SCHEMBL29067197 | 0.75 | PKM (0.47) | MEN1KMT2APTPRA | |
| SCHEMBL29067192 | 0.75 | NPC1 (0.44) | MEN1KMT2AGRIN1GRIN2BGRIN2D | |
| SCHEMBL29067185 | 0.74 | GRIN2D (0.42) | MEN1KMT2AGRIN1GRIN2BGRIN2D | |
| SCHEMBL29067186 | 0.74 | ALDH1A1 (0.51) | MEN1KMT2AGRIN1GRIN2BGRIN2D |
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-116715622-A | Synthesis method of 2- (2-arylbutyl) pyridine compound | 河南大学 | 2023-09-08 | — | — | CN | disclosed |