Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 11/20 | 0.41 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27750703 | 0.84 | BACE1 (0.55) | BACE1BACE2KCNH2ALDH1A1SRC | |
| SCHEMBL2084528 | 0.81 | BACE1 (0.49) | BACE1BACE2KCNH2CTSD | |
| Trifluoroacetic Acid SCHEMBL2085926 | 0.78 | BACE1 (0.52) | BACE1BACE2KCNH2CTSD | |
| Acetic Acid SCHEMBL2085899 | 0.76 | BACE1 (0.52) | BACE1BACE2KCNH2CTSD | |
| Trifluoroacetic Acid SCHEMBL3989364 | 0.76 | BACE1 (0.40) | BACE1BACE2KCNH2CTSDL3MBTL1 | |
| Acetic Acid SCHEMBL2084828 | 0.76 | BACE1 (0.47) | BACE1BACE2KCNH2NPC1MAPT | |
| SCHEMBL3550485 | 0.76 | BACE1 (0.58) | BACE1BACE2KCNH2CTSD | |
| Trifluoroacetic Acid SCHEMBL2086314 | 0.75 | BACE1 (0.65) | BACE1BACE2KCNH2CTSD | |
| Trifluoroacetic Acid SCHEMBL2087790 | 0.75 | BACE1 (0.43) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL3989365 | 0.75 | BACE1 (0.39) | BACE1BACE2KCNH2CTSD |
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 |
|---|---|---|---|---|---|---|---|
| EP-2035378-A1 | SUBSTITUTED ISOINDOLES AS BACE INHIBITORS AND THEIR USE | AstraZeneca AB (SE) | 2009-03-18 | — | — | EP | claimed |
| WO-2007149033-A1 | SUBSTITUTED ISOINDOLES AS BACE INHIBITORS AND THEIR USE | ASTRAZENECA AB (SE) | 2007-12-27 | — | — | WO | claimed |