Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 12/20 | 0.46 |
| ▸ | BACE2 | Q9Y5Z0 | 6/20 | 0.45 |
| ▸ | GRM4 | Q14833 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17277722 | 0.85 | BACE1 (0.52) | BACE1BACE2GRM4KCNH2NPC1 | |
| SCHEMBL7933959 | 0.83 | BACE1 (0.48) | BACE1BACE2 | |
| SCHEMBL7940427 | 0.80 | SMN1; SMN2 (0.48) | BACE1BACE2GRM4NPC1RAB9A | |
| SCHEMBL7942651 | 0.79 | BACE1 (0.47) | BACE1BACE2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15443906 | 0.77 | BACE1 (0.53) | BACE1BACE2GRM4NPC1RAB9A | |
| SCHEMBL7942303 | 0.76 | NPC1 (0.53) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14734050 | 0.75 | BACE1 (0.50) | BACE1BACE2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7941769 | 0.74 | POLB (0.54) | BACE1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8027585 | 0.73 | MPO (0.50) | RAB9ASMN1; SMN2 | |
| SCHEMBL7942306 | 0.73 | MEN1 (0.51) | GRM4NPC1RAB9ASMN1; SMN2 |
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-2010047372-A1 | 2-AMINOPYRIDIN-4-ONE AND 2-AMINOPYRIDINE DERIVATIVE BOTH HAVING BACE1-INHIBITING ACTIVITY | 塩野義製薬株式会社 (JP) | 2010-04-29 | — | — | WO | disclosed |