Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.46 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.46 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | PREP | P48147 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | KLK7 | P49862 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23556140 | 1.00 | PDK1 (0.46) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL30007538 | 1.00 | PDK1 (0.46) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL16892005 | 1.00 | PDK1 (0.46) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL30161838 | 1.00 | PDK1 (0.46) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL31200624 | 0.90 | SMN1; SMN2 (0.49) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL31200555 | 0.88 | SMN1; SMN2 (0.47) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL15816909 | 0.88 | SMN1; SMN2 (0.47) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL15816908 | 0.88 | SMN1; SMN2 (0.47) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL29725261 | 0.87 | MEN1 (0.48) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL17693038 | 0.87 | PARP1 (0.49) | PDK1PDK2PDK3PDK4MEN1 |
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-4077305-A1 | HETEROARYLDIHYDROPYRIMIDINE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS | Janssen Pharmaceutica NV (BE) | 2022-10-26 | — | — | EP | disclosed |