Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HK1 | P19367 | 2/20 | 0.73 |
| ▸ | HK2 | P52789 | 2/20 | 0.73 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | PYGL | P06737 | 8/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CCR2 | P41597 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9937824 | 0.84 | HK2 (1.00) | HK1HK2PTGS2ALDH1A1PYGL | |
| SCHEMBL9937827 | 0.84 | HK2 (1.00) | HK1HK2PTGS2ALDH1A1PYGL | |
| SCHEMBL9971366 | 0.72 | HK1 (0.62) | HK1HK2PTGS2ALDH1A1PYGL | |
| SCHEMBL23705267 | 0.65 | CYP3A4 (0.44) | ALDH1A1HTT | |
| SCHEMBL25867388 | 0.65 | CYP3A4 (0.44) | ALDH1A1HTT | |
| SCHEMBL9971337 | 0.65 | SLC12A2 (0.54) | ALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL9938706 | 0.65 | HK1 (1.00) | HK1HK2PYGL | |
| SCHEMBL9938700 | 0.65 | HK1 (1.00) | HK1HK2PYGL | |
| SCHEMBL31528736 | 0.63 | PYGL (0.73) | HK1HK2ALDH1A1PYGLLMNA | |
| SCHEMBL9937889 | 0.63 | HK1 (0.76) | HK1HK2PYGL |
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-2012083145-A1 | GLUCOSAMINE DERIVATIVES | GLAXO WELLCOME MANUFACTURING PTE LTD (SG) | 2012-06-21 | — | — | WO | disclosed |