Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP2 | P42575 | 1/20 | 0.48 |
| ▸ | GBA1 | P04062 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 3/20 | 0.37 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16405256 | 0.79 | CASP2 (0.60) | CASP2GBA1TSHRHPGDNAAA | |
| SCHEMBL17752144 | 0.79 | GBA1 (0.50) | CASP2GBA1TSHRHPGDHDAC3 | |
| SCHEMBL14976750 | 0.78 | CASP2 (0.57) | CASP2GBA1HPGDHDAC3HDAC1 | |
| SCHEMBL7780941 | 0.77 | TSHR (0.39) | TSHRHPGDALDH1A1 | |
| SCHEMBL1101631 | 0.76 | ALDH1A1 (0.56) | CASP2GBA1HPGDHDAC3HDAC1 | |
| SCHEMBL16405258 | 0.75 | GBA1 (0.47) | CASP2GBA1TSHRHPGDHDAC3 | |
| SCHEMBL2633147 | 0.75 | CASP2 (0.70) | CASP2HPGDHDAC3HDAC1HDAC2 | |
| SCHEMBL18874843 | 0.74 | GBA1 (0.46) | CASP2GBA1TSHRHPGDHDAC3 | |
| SCHEMBL10025175 | 0.73 | CASP2 (0.52) | CASP2GBA1HPGDHDAC3HDAC1 | |
| SCHEMBL5500002 | 0.73 | CASP2 (0.57) | CASP2GBA1TSHRHPGDHDAC3 |
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-0688314-B1 | PRODRUG DERIVATIVES OF ENZYME INHIBITORS WITH HYDROXYL GROUPS, METHODS OF PREPARING THEM AND THEIR USE | HOECHST AG (DE) | 2001-10-04 | — | — | EP | disclosed |