Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HK1 | P19367 | 8/20 | 0.48 |
| ▸ | HK2 | P52789 | 8/20 | 0.48 |
| ▸ | GCK | P35557 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9971322 | 0.86 | HK1 (0.45) | HK1HK2GCKHDAC8DRD2 | |
| SCHEMBL9938055 | 0.82 | HK1 (0.61) | HK1HK2GCK | |
| SCHEMBL9938044 | 0.82 | HK1 (0.61) | HK1HK2GCK | |
| SCHEMBL9971328 | 0.77 | HK1 (0.50) | HK1HK2GCKHDAC8DRD2 | |
| SCHEMBL9971365 | 0.77 | HK1 (0.65) | HK1HK2GCKHDAC8DRD2 | |
| SCHEMBL9938990 | 0.76 | HK1 (0.74) | HK1HK2 | |
| SCHEMBL9938997 | 0.76 | HK1 (0.74) | HK1HK2 | |
| SCHEMBL9971335 | 0.73 | HK1 (0.40) | HK1HK2GCKKDM4EALDH1A1 | |
| SCHEMBL9971310 | 0.72 | HK1 (0.56) | HK1HK2GCK | |
| SCHEMBL9971381 | 0.71 | ALDH1A1 (0.41) | HK1HK2KDM4EALDH1A1HPGD |
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 |