Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | PDK2 | Q15119 | 9/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PTPRC | P08575 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | S100A4 | P26447 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13776781 | 0.91 | MEN1 (0.45) | CYP2A6PDK2KDM4EMEN1MAPT | |
| SCHEMBL19797297 | 0.90 | PDK2 (0.45) | CYP2A6PDK2KDM4EMEN1MAPT | |
| SCHEMBL30366323 | 0.90 | PDK2 (0.53) | CYP2A6PDK2KDM4EMEN1MAPT | |
| SCHEMBL19797296 | 0.90 | PDK2 (0.53) | CYP2A6PDK2KDM4EMEN1MAPT | |
| SCHEMBL19822248 | 0.90 | PDK2 (0.53) | CYP2A6PDK2KDM4EMEN1MAPT | |
| SCHEMBL25648741 | 0.90 | PDK2 (0.45) | CYP2A6PDK2KDM4EMEN1MAPT | |
| SCHEMBL19395214 | 0.88 | PDK2 (0.51) | CYP2A6PDK2KDM4EMEN1MAPT | |
| SCHEMBL19395208 | 0.88 | PDK2 (0.51) | CYP2A6PDK2KDM4EMEN1MAPT | |
| SCHEMBL20225279 | 0.85 | PDK2 (0.49) | CYP2A6PDK2KDM4EMEN1MAPT | |
| SCHEMBL19151998 | 0.85 | BIRC5 (0.39) | CYP2A6PDK2CYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020231197-A1 | ORGANIC ELECTRIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRIC ELEMENT, AND ELECTRONIC DEVICE THEREOF | 덕산네오룩스 주식회사 | 2020-11-19 | — | — | WO | disclosed |