Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4760910 | 0.80 | PLAU (0.40) | ALDH1A1MEN1KMT2AMAPTRAB9A | |
| SCHEMBL27539686 | 0.77 | CYP11B1 (0.50) | GABRA1GABRB2ALDH1A1MEN1KMT2A | |
| SCHEMBL24968896 | 0.76 | ALDH1A1 (0.44) | HTR1AADRA2AADRA2BADRA2CALDH1A1 | |
| SCHEMBL5831736 | 0.75 | GABRA1 (0.45) | GABRA1GABRB2ALDH1A1MEN1KMT2A | |
| SCHEMBL27949836 | 0.71 | GAA (0.41) | GABRA1GABRB2ALDH1A1MEN1KMT2A | |
| SCHEMBL5449547 | 0.71 | IMPDH2 (0.31) | GABRA1GABRB2 | |
| SCHEMBL5831594 | 0.71 | GABRA1 (0.56) | GABRA1GABRB2ALDH1A1MEN1KMT2A | |
| SCHEMBL31619949 | 0.71 | GABRA1 (0.56) | GABRA1GABRB2ALDH1A1MEN1KMT2A | |
| SCHEMBL5353000 | 0.70 | CYP11B1 (0.44) | GABRA1GABRB2ADRA2AADRA2BADRA2C | |
| SCHEMBL131316 | 0.70 | PLAU (0.46) | ALDH1A1KMT2AMAPTRAB9ASMN1; SMN2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104478799-B | The preparation method of 1,4-diallyl isoquinolin | 上海交通大学 | 2016-11-16 | — | — | CN | claimed |
| CN-104478799-B | The preparation method of 1,4-diallyl isoquinolin | 上海交通大学 | 2016-11-16 | — | — | CN | disclosed |
| CN-104478799-B | The preparation method of 1,4-diallyl isoquinolin | 上海交通大学 | 2016-11-16 | — | — | CN | disclosed |
| CN-104478799-A | Preparation method of 1,4-diallyl isoquinoline | UNIV SHANGHAI JIAOTONG | 2015-04-01 | — | — | CN | disclosed |
| CN-104478799-A | Preparation method of 1,4-diallyl isoquinoline | UNIV SHANGHAI JIAOTONG | 2015-04-01 | — | — | CN | disclosed |