Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 9/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.38 |
| ▸ | RORB | Q92753 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 2/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL22609091 | 1.00 | PDK2 (0.45) | PDK2CYP1A2CYP2C19KMT2APTGER1 | |
| SCHEMBL14099219 | 0.88 | PDK2 (0.55) | PDK2CYP1A2CYP2C19KMT2ALMNA | |
| SCHEMBL19152841 | 0.85 | PDK2 (0.55) | PDK2 | |
| SCHEMBL16547420 | 0.85 | PDK2 (0.45) | PDK2CYP1A2CYP2C19KMT2ALMNA | |
| SCHEMBL5346770 | 0.83 | PDK2 (0.49) | PDK2CYP1A2CYP2C19KMT2ALMNA | |
| SCHEMBL22609095 | 0.80 | PDK2 (0.45) | PDK2F2 | |
| SCHEMBL824181 | 0.79 | PDK2 (0.47) | PDK2CYP1A2SLC6A3 | |
| SCHEMBL31497073 | 0.79 | PDK2 (0.46) | PDK2SLC6A3 | |
| SCHEMBL19797279 | 0.77 | PDK2 (0.51) | PDK2KMT2A | |
| SCHEMBL19168997 | 0.75 | PDK2 (0.55) | PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3962895-A1 | COMPOUNDS COMPRISING A HETERO-FLUORENE GROUP | Novaled GmbH (DE) | 2022-03-09 | — | — | EP | disclosed |