Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 4/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAF1 | P04049 | 1/20 | 0.37 |
| ▸ | BRAF | P15056 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | PDE1A | P54750 | 1/20 | 0.36 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.36 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.36 |
| ▸ | ACKR3 | P25106 | 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 | |
|---|---|---|---|---|
| SCHEMBL12445846 | 0.85 | GRM4 (0.38) | BACE1RAB9A | |
| SCHEMBL12445476 | 0.81 | BACE1 (0.61) | BACE1 | |
| SCHEMBL7932668 | 0.77 | BACE1 (0.71) | BACE1HDAC1HDAC6GAAMAPT | |
| SCHEMBL12445770 | 0.77 | BACE1 (0.51) | BACE1 | |
| SCHEMBL12446184 | 0.77 | BACE1 (0.53) | BACE1HDAC1HDAC6PARP1 | |
| SCHEMBL7942075 | 0.77 | ALDH1A1 (0.51) | BACE1HDAC1HDAC6RAB9APARP1 | |
| SCHEMBL7943333 | 0.76 | HDAC1 (0.48) | BACE1HDAC1HDAC6ALDH1A1ALOX15 | |
| SCHEMBL12446154 | 0.76 | BACE1 (0.54) | BACE1HDAC1HDAC6PARP1ALDH1A1 | |
| SCHEMBL12445462 | 0.75 | BACE1 (0.55) | BACE1HDAC1HDAC6PARP1 | |
| SCHEMBL12445826 | 0.74 | SMN1; SMN2 (0.58) | RAB9AALDH1A1GAAMAPTACKR3 |
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-2360155-A1 | 2-AMINOPYRIDIN-4-ONE AND 2-AMINOPYRIDINE DERIVATIVE BOTH HAVING BACE1-INHIBITING ACTIVITY | Shionogi & Co., Ltd. (JP) | 2011-08-24 | — | — | EP | disclosed |