Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | HTR5A | P47898 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24570534 | 0.81 | HTR2A (0.37) | PDK2LMNAMAPTSMN1; SMN2KDM4E | |
| SCHEMBL29416297 | 0.77 | LMNA (0.47) | PDK2PDK4LMNAMAPTSMN1; SMN2 | |
| SCHEMBL18314522 | 0.77 | LMNA (0.47) | PDK2PDK4LMNAMAPTSMN1; SMN2 | |
| SCHEMBL12776555 | 0.76 | PDK2 (0.46) | PDK2PDK4KDM4EHTR5A | |
| SCHEMBL21585374 | 0.74 | PDK2 (0.40) | PDK2PDK4LMNAMAPTSMN1; SMN2 | |
| SCHEMBL21585297 | 0.73 | PDK2 (0.39) | PDK2PDK4LMNAMAPTSMN1; SMN2 | |
| SCHEMBL24750418 | 0.72 | PDK2 (0.38) | PDK2LMNAMAPTSMN1; SMN2KDM4E | |
| SCHEMBL25303926 | 0.71 | ALDH1A1 (0.43) | LMNAMAPTSMN1; SMN2KDM4EMEN1 | |
| SCHEMBL22481656 | 0.71 | PDK2 (0.54) | PDK2PDK4LMNAMAPTSMN1; SMN2 | |
| SCHEMBL24871191 | 0.71 | PDK2 (0.43) | PDK2CHRM2KCNH2 |
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-2019228430-A1 | KETONE-CONTAINING COMPOUND AND USE THEREOF IN ORGANIC ELECTROLUMINESCENT DEVICE | 江苏三月光电科技有限公司 (CN) | 2019-12-05 | — | — | WO | disclosed |