Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 3/20 | 0.51 |
| ▸ | CTSK | P43235 | 3/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 3/20 | 0.45 |
| ▸ | CACNA1B | Q00975 | 6/20 | 0.44 |
| ▸ | PPARG | P37231 | 2/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31407349 | 1.00 | CTSS (0.51) | CTSSCTSKHDAC4HDAC1HDAC6 | |
| SCHEMBL2780551 | 1.00 | CTSS (0.51) | CTSSCTSKHDAC4HDAC1HDAC6 | |
| SCHEMBL25178783 | 0.96 | PPARA (0.49) | CTSSCTSKHDAC4HDAC1HDAC6 | |
| SCHEMBL25172772 | 0.93 | PPARA (0.48) | CTSSCTSKHDAC4HDAC1HDAC6 | |
| SCHEMBL25172771 | 0.93 | PPARA (0.48) | CTSSCTSKHDAC4HDAC1HDAC6 | |
| SCHEMBL26984477 | 0.93 | PPARA (0.48) | CTSSCTSKHDAC4HDAC1HDAC6 | |
| SCHEMBL31407680 | 0.86 | PPARA (0.44) | CTSSCTSKHDAC4HDAC1HDAC6 | |
| SCHEMBL31407498 | 0.86 | PPARA (0.44) | CTSSCTSKHDAC4HDAC1HDAC6 | |
| SCHEMBL17457748 | 0.83 | CTSK (0.46) | CTSSCTSKHDAC4HDAC1HDAC6 | |
| SCHEMBL8306861 | 0.83 | CTSK (0.46) | CTSSCTSKHDAC4HDAC1HDAC6 |
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-2010091104-A1 | GLUCOSYLCERAMIDE SYNTHASE INHIBITORS | EXELIXIS, INC. (US) | 2010-08-12 | — | — | WO | disclosed |