Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 10/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 10/20 | 0.46 |
| ▸ | PDK3 | Q15120 | 10/20 | 0.46 |
| ▸ | PDK4 | Q16654 | 10/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | JAK3 | P52333 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CETP | P11597 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1291381 | 1.00 | PDK1 (0.46) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL13482713 | 0.84 | L3MBTL1 (0.43) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL2432483 | 0.84 | MEN1 (0.44) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL25368134 | 0.83 | L3MBTL1 (0.42) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL14637963 | 0.81 | LMNA (0.46) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL30681715 | 0.81 | LMNA (0.46) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL23844276 | 0.81 | LMNA (0.41) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL4417950 | 0.81 | PDK1 (0.41) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL5407222 | 0.79 | PDK1 (0.48) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL2430587 | 0.79 | PDK1 (0.42) | PDK1PDK2PDK3PDK4LMNA |
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-2022053010-A1 | FUSED RING PYRIMIDONE DERIVATIVES FOR USE IN THE TREATMENT OF HBV INFECTION OR OF HBV-INDUCED DISEASES | Janssen Sciences Ireland Unlimited Company (IE) | 2022-03-17 | — | — | WO | disclosed |