Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 13/20 | 0.39 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.38 |
| ▸ | FEN1 | P39748 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 4/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | CTSD | P07339 | 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 | |
|---|---|---|---|---|
| SCHEMBL27460349 | 0.86 | PDK2 (0.44) | ATMPDK2BACE1KCNH2CTSD | |
| SCHEMBL22428415 | 0.86 | PDK2 (0.44) | ATMPDK2BACE1KCNH2CTSD | |
| SCHEMBL2961760 | 0.84 | PDK2 (0.45) | PDK2KCNH2 | |
| SCHEMBL22428444 | 0.83 | PDK2 (0.42) | ATMPDK2BACE1KCNH2CTSD | |
| SCHEMBL9975000 | 0.80 | ALOX5AP (0.43) | PDK2ALOX5APFEN1BACE1 | |
| SCHEMBL30595509 | 0.79 | PDK2 (0.46) | PDK2KCNH2 | |
| SCHEMBL30009790 | 0.79 | PDK2 (0.50) | PDK2 | |
| SCHEMBL9975009 | 0.78 | PDK2 (0.41) | PDK2 | |
| SCHEMBL1649136 | 0.78 | PDK2 (0.47) | PDK2 | |
| SCHEMBL22428446 | 0.78 | PDK2 (0.43) | PDK2BACE1KCNH2 |
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-2012081541-A1 | 1, 2, 4, 5-SUBSTITUTED PHENYL DERIVATIVE, PRODUCTION METHOD FOR SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT | 東ソー株式会社 (JP) | 2012-06-21 | — | — | WO | disclosed |