Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 8/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 8/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.45 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 3/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12445543 | 0.85 | EGFR (0.53) | NPC1RAB9ALMNASMN1; SMN2EGFR | |
| SCHEMBL7944484 | 0.85 | BACE1 (0.48) | NPC1RAB9ALMNASMN1; SMN2EGFR | |
| SCHEMBL12445687 | 0.79 | KMT2A (0.46) | NPC1RAB9ALMNASMN1; SMN2BACE1 | |
| SCHEMBL12445785 | 0.77 | BACE1 (0.51) | BACE1 | |
| SCHEMBL12446250 | 0.77 | BACE1 (0.48) | NPC1RAB9ASMN1; SMN2BACE1KDM4E | |
| SCHEMBL12445801 | 0.77 | NPC1 (0.44) | NPC1RAB9ASMN1; SMN2BACE1ALDH1A1 | |
| SCHEMBL12445802 | 0.76 | BACE1 (0.47) | NPC1RAB9ASMN1; SMN2BACE1ALDH1A1 | |
| SCHEMBL12446242 | 0.75 | BACE1 (0.44) | RAB9ABACE1KDM4EGAA | |
| SCHEMBL12445678 | 0.75 | BACE1 (0.42) | BACE1 | |
| SCHEMBL12445672 | 0.74 | BACE1 (0.49) | NPC1RAB9ABACE1APPKDM4E |
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 |