Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.48 |
| ▸ | FDPS | P14324 | 1/20 | 0.47 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.46 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.46 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.46 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.46 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.46 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | PTPRA | P18433 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | LIN28A | Q9H9Z2 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8862781 | 0.83 | HRH1 (0.44) | HRH1FDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL5556933 | 0.82 | HRH1 (0.47) | HRH1FDPSGRIN2DGRIN3BGRIN1 | |
| Hydrochloric Acid SCHEMBL8862622 | 0.82 | L3MBTL1 (0.45) | HRH1FDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL231091 | 0.81 | FDPS (0.56) | HRH1FDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL31312939 | 0.81 | HRH1 (0.54) | HRH1FDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL2241279 | 0.78 | FDPS (0.54) | HRH1FDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8750597 | 0.78 | FDPS (0.46) | HRH1FDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL15452687 | 0.78 | FDPS (0.46) | HRH1FDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL29380824 | 0.78 | FDPS (0.54) | HRH1FDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL761426 | 0.78 | CETP (0.59) | GRIN1GRIN2BTDP1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106432063-A | Synthetic method of perhexiline drug intermediate alpha-(2,2-diphenyl vinyl) pyridine | 厦门市凯尔利信息科技有限公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-105503702-A | Synthesis method of perhexiline drug intermediate alpha-(2,2-diphenyl vinyl) pyridine | CHENGDU QIANYE LONGHUA PETROLEUM ENG TECH CONSULTING CO LTD | 2016-04-20 | — | — | CN | disclosed |