Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 2/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.36 |
| ▸ | PDE4A | P27815 | 2/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.36 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.36 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28069366 | 0.86 | MAPK1 (0.43) | BACE1PDE4BHDAC4HDAC2HDAC8 | |
| SCHEMBL10495879 | 0.80 | ALDH1A1 (0.42) | CNR1CNR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6320034 | 0.78 | CYP1A2 (0.53) | BACE1PTPN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2596765 | 0.78 | SHBG (0.39) | BACE1CYP3A4PTPN5 | |
| SCHEMBL2995994 | 0.77 | CYP3A4 (0.44) | CNR1CNR2BACE1PTPN1CYP1A2 | |
| SCHEMBL199860 | 0.77 | SHBG (0.47) | BACE1PDE4BHDAC4HDAC2HDAC8 | |
| SCHEMBL14820672 | 0.75 | CYP1A2 (0.50) | BACE1PTPN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5706284 | 0.75 | CNR1 (0.48) | CNR1CNR2BACE1PDE4BPTPN1 | |
| SCHEMBL200188 | 0.73 | BACE1 (0.49) | BACE1PDE4BHDAC4HDAC2HDAC8 | |
| SCHEMBL296464 | 0.73 | BACE1 (0.49) | CNR1CNR2BACE1PDE4BHDAC4 |
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-106009182-B | A kind of high-strength nuclear power polyvinyl piping materials | 上海中塑管业有限公司 | 2018-10-30 | — | — | CN | disclosed |