Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 13/20 | 0.55 |
| ▸ | BACE2 | Q9Y5Z0 | 7/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3635701 | 0.79 | BACE1 (0.53) | BACE1KCNH2BACE2 | |
| SCHEMBL3780855 | 0.76 | BACE1 (0.83) | BACE1KCNH2BACE2 | |
| SCHEMBL3544023 | 0.71 | BACE1 (1.00) | BACE1KCNH2BACE2 | |
| SCHEMBL3636240 | 0.69 | BACE1 (0.72) | BACE1KCNH2BACE2 | |
| SCHEMBL2469832 | 0.68 | BACE1 (1.00) | BACE1KCNH2BACE2 | |
| SCHEMBL2463319 | 0.68 | BACE1 (1.00) | BACE1KCNH2BACE2 | |
| SCHEMBL2499171 | 0.68 | BACE1 (1.00) | BACE1KCNH2BACE2 | |
| SCHEMBL3360071 | 0.68 | BACE1 (0.52) | BACE1KCNH2BACE2 | |
| SCHEMBL2086154 | 0.68 | BACE1 (0.76) | BACE1KCNH2BACE2 | |
| SCHEMBL2085904 | 0.68 | BACE1 (0.76) | BACE1KCNH2BACE2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2155749-A1 | PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS BACE INHIBITORS | AstraZeneca AB (SE) | 2010-02-24 | — | — | EP | claimed |
| WO-2009022961-A1 | PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS BACE INHIBITORS | ASTRAZENECA AB (SE) | 2009-02-19 | — | — | WO | claimed |
| EP-2155749-A1 | PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS BACE INHIBITORS | AstraZeneca AB (SE) | 2010-02-24 | — | — | EP | disclosed |
| WO-2009022961-A1 | PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS BACE INHIBITORS | ASTRAZENECA AB (SE) | 2009-02-19 | — | — | WO | disclosed |