Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCI | P41743 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 8/20 | 0.40 |
| ▸ | SORT1 | Q99523 | 3/20 | 0.40 |
| ▸ | F2R | P25116 | 2/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | PRMT3 | O60678 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7941942 | 0.87 | SORT1 (0.41) | PRKCIBACE1SORT1APPTSHR | |
| SCHEMBL12815455 | 0.78 | KDM4E (0.41) | CYP3A4ALDH1A1 | |
| SCHEMBL7943969 | 0.75 | PRKCI (0.47) | PRKCIBACE1APPCYP3A4BACE2 | |
| SCHEMBL12446209 | 0.74 | PRKCI (0.42) | PRKCIBACE1SORT1BACE2ALDH1A1 | |
| SCHEMBL12445675 | 0.73 | BACE1 (0.49) | BACE1BACE2 | |
| SCHEMBL12446237 | 0.73 | BACE1 (0.47) | PRKCIBACE1BACE2HTT | |
| SCHEMBL12445674 | 0.73 | BACE1 (0.47) | PRKCIBACE1BACE2 | |
| SCHEMBL12445874 | 0.72 | ALDH1A1 (0.37) | PRKCIBACE1ALDH1A1TYK2TSHR | |
| SCHEMBL12445871 | 0.71 | BACE1 (0.47) | BACE1BACE2 | |
| SCHEMBL12445846 | 0.71 | GRM4 (0.38) | PRKCIBACE1 |
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 |