Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 5/20 | 0.46 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14600396 | 1.00 | PDK2 (0.46) | PDK2PDE10ACHRNB4CHRNA3CHRNA7 | |
| SCHEMBL14600458 | 0.99 | PDK2 (0.45) | PDK2PDE10ACHRNB4CHRNA3CHRNA7 | |
| SCHEMBL14600371 | 0.99 | PDK2 (0.45) | PDK2PDE10ACHRNB4CHRNA3CHRNA7 | |
| SCHEMBL14600426 | 0.98 | PDK2 (0.44) | PDK2PDE10ACHRNB4CHRNA3CHRNA7 | |
| SCHEMBL14600347 | 0.96 | PDK2 (0.43) | PDK2PDE10ACHRNB4CHRNA3CHRNA7 | |
| SCHEMBL14600419 | 0.95 | PDK2 (0.42) | PDK2PDE10ACHRNB4CHRNA3CHRNA7 | |
| SCHEMBL14600327 | 0.91 | PDK2 (0.46) | PDK2CHRNB4CHRNA3CHRNA7KDM4E | |
| SCHEMBL416688 | 0.88 | APEX1 (0.38) | PDK2 | |
| SCHEMBL14600324 | 0.86 | PDK2 (0.47) | PDK2PDE10AKDM4EALDH1A1CYP1A2 | |
| SCHEMBL14600390 | 0.86 | PDK2 (0.47) | PDK2PDE10AKDM4EALDH1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7166240-B2 | Hydrocarbon compounds, materials for organic electroluminescent elements and organic electroluminescent elements | MITSUI CHEMICALS, INC. (JP) | 2007-01-23 | — | — | US | disclosed |