Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 3/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.38 |
| ▸ | NOS2 | P35228 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2086835 | 0.87 | KCNH2 (0.44) | BACE1KCNH2SMN1; SMN2PDK2NOS2 | |
| SCHEMBL2085052 | 0.79 | KCNH2 (0.48) | BACE1KCNH2SMN1; SMN2PDK2NOS2 | |
| SCHEMBL2086657 | 0.77 | BACE1 (0.56) | BACE1KCNH2SMN1; SMN2NOS2LMNA | |
| SCHEMBL2085820 | 0.68 | HTR5A (0.50) | BACE1KCNH2SMN1; SMN2NOS2ALDH1A1 | |
| SCHEMBL19326649 | 0.65 | LMNA (0.47) | SMN1; SMN2PDK2ALOX15TSHRALDH1A1 | |
| SCHEMBL5667143 | 0.65 | LMNA (0.47) | SMN1; SMN2PDK2ALOX15TSHRALDH1A1 | |
| SCHEMBL29646285 | 0.65 | ESR1 (0.50) | SMN1; SMN2PDK2ALOX15TSHRALDH1A1 | |
| SCHEMBL29482233 | 0.65 | ESR1 (0.50) | SMN1; SMN2PDK2ALOX15TSHRALDH1A1 | |
| SCHEMBL382439 | 0.65 | ESR1 (0.50) | SMN1; SMN2PDK2ALOX15TSHRALDH1A1 | |
| SCHEMBL8984563 | 0.64 | ALOX15 (0.46) | SMN1; SMN2PDK2ALOX15TSHRALDH1A1 |
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 | disclosed |
| WO-2007149033-A1 | SUBSTITUTED ISOINDOLES AS BACE INHIBITORS AND THEIR USE | ASTRAZENECA AB (SE) | 2007-12-27 | — | — | WO | disclosed |