Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.47 |
| ▸ | ABCC9 | O60706 | 2/20 | 0.43 |
| ▸ | ABCC8 | Q09428 | 2/20 | 0.43 |
| ▸ | KCNJ11 | Q14654 | 2/20 | 0.43 |
| ▸ | KCNJ8 | Q15842 | 2/20 | 0.43 |
| ▸ | PDK1 | Q15118 | 3/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.43 |
| ▸ | PDK3 | Q15120 | 3/20 | 0.43 |
| ▸ | PDK4 | Q16654 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4625938 | 1.00 | MCOLN3 (0.47) | MCOLN3ABCC9ABCC8KCNJ11KCNJ8 | |
| SCHEMBL4626538 | 0.87 | ABCC9 (0.45) | ABCC9ABCC8KCNJ11KCNJ8PDK1 | |
| SCHEMBL4626536 | 0.87 | ABCC9 (0.45) | ABCC9ABCC8KCNJ11KCNJ8PDK1 | |
| SCHEMBL4626416 | 0.76 | ALDH1A1 (0.52) | ALDH1A1 | |
| SCHEMBL4626412 | 0.76 | ALDH1A1 (0.52) | ALDH1A1 | |
| SCHEMBL4625119 | 0.72 | PDK2 (0.55) | PDK1PDK2PDK3PDK4 | |
| SCHEMBL4657256 | 0.72 | PDK2 (0.55) | PDK1PDK2PDK3PDK4 | |
| SCHEMBL4625122 | 0.72 | PDK2 (0.55) | PDK1PDK2PDK3PDK4 | |
| SCHEMBL4626461 | 0.71 | PDK2 (0.54) | PDK1PDK2PDK3PDK4 | |
| SCHEMBL4626464 | 0.71 | PDK2 (0.54) | PDK1PDK2PDK3PDK4 |
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-1214287-B1 | AMIDES AS INHIBITORS FOR PYRUVATE DEHYDROGENASE | ASTRAZENECA AB (SE) | 2008-07-02 | — | — | EP | disclosed |