Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 12/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | BACE2 | Q9Y5Z0 | 4/20 | 0.32 |
| ▸ | CTSD | P07339 | 3/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.30 |
| ▸ | HTR6 | P50406 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6887443 | 0.87 | BACE1 (0.42) | BACE1KCNH2DPP4BACE2CTSD | |
| SCHEMBL6885096 | 0.85 | BACE1 (0.51) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL6887086 | 0.81 | BACE1 (0.37) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL930770 | 0.77 | BACE1 (0.39) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL930773 | 0.77 | BACE1 (0.39) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL931078 | 0.77 | BACE1 (0.34) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL930705 | 0.76 | DPP4 (0.32) | BACE1DPP4CTSDHTR6 | |
| SCHEMBL6886273 | 0.75 | BACE1 (0.42) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL6884548 | 0.73 | BACE1 (0.54) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL932097 | 0.73 | BACE1 (0.39) | BACE1KCNH2BACE2CTSD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011002409-A1 | 5H-PYRROLO[3,4-£>]PYRAZIN-7-AMINE DERIVATIVES INHIBITORS OF BETA-SECRETASE | ASTRAZENECA AB (SE) | 2011-01-06 | — | — | WO | disclosed |
| WO-2011002409-A1 | 5H-PYRROLO[3,4-£>]PYRAZIN-7-AMINE DERIVATIVES INHIBITORS OF BETA-SECRETASE | ASTRAZENECA AB (SE) | 2011-01-06 | — | — | WO | disclosed |