Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.67 |
| ▸ | GBA1 | P04062 | 4/20 | 0.67 |
| ▸ | MAPT | P10636 | 3/20 | 0.67 |
| ▸ | POLB | P06746 | 2/20 | 0.67 |
| ▸ | PLEC | Q15149 | 1/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.60 |
| ▸ | HPGD | P15428 | 4/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | BLK | P51451 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | PDE2A | O00408 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9926704 | 0.88 | ALDH1A1 (0.70) | ALDH1A1GBA1MAPTPOLBPLEC | |
| SCHEMBL15992913 | 0.87 | ALDH1A1 (0.69) | ALDH1A1GBA1MAPTPOLBPLEC | |
| SCHEMBL9926634 | 0.87 | GBA1 (0.73) | ALDH1A1GBA1MAPTPOLBPLEC | |
| SCHEMBL9926641 | 0.87 | GBA1 (0.73) | ALDH1A1GBA1MAPTPOLBPLEC | |
| SCHEMBL15992521 | 0.86 | ALDH1A1 (0.67) | ALDH1A1GBA1MAPTPOLBPLEC | |
| SCHEMBL9926658 | 0.86 | ALDH1A1 (0.67) | ALDH1A1GBA1MAPTPOLBPLEC | |
| SCHEMBL15993521 | 0.84 | ALDH1A1 (0.65) | ALDH1A1GBA1MAPTPOLBPLEC | |
| SCHEMBL18261984 | 0.84 | ALDH1A1 (0.65) | ALDH1A1GBA1MAPTPOLBPLEC | |
| SCHEMBL15992475 | 0.84 | GBA1 (0.66) | ALDH1A1GBA1MAPTPOLBPLEC | |
| SCHEMBL9926550 | 0.84 | MAPT (0.64) | ALDH1A1GBA1MAPTPOLBPLEC |
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-2012078855-A1 | SUBSTITUTED PYRAZOLOPYRIMIDINES AS GLUCOCEREBROSIDASE ACTIVATORS | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2012-06-14 | — | — | WO | disclosed |