Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 8/20 | 0.49 |
| ▸ | CTSD | P07339 | 5/20 | 0.49 |
| ▸ | BACE2 | Q9Y5Z0 | 5/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8225744 | 0.91 | BACE1 (0.62) | BACE1CTSDBACE2KCNH2CYP11B1 | |
| SCHEMBL3548697 | 0.84 | BACE1 (0.62) | BACE1CTSDBACE2KCNH2CYP11B1 | |
| SCHEMBL2086817 | 0.83 | BACE1 (0.43) | BACE1CTSDBACE2KCNH2SLC6A3 | |
| SCHEMBL13039878 | 0.83 | BACE1 (0.43) | BACE1CTSDBACE2KCNH2SLC6A3 | |
| SCHEMBL3552663 | 0.83 | BACE1 (0.69) | BACE1CTSDBACE2KCNH2 | |
| SCHEMBL3548927 | 0.81 | BACE1 (0.64) | BACE1CTSDBACE2KCNH2 | |
| SCHEMBL3544331 | 0.78 | BACE1 (0.51) | BACE1CTSDBACE2KCNH2 | |
| SCHEMBL3559550 | 0.77 | BACE1 (0.48) | BACE1CTSDBACE2KCNH2MAPT | |
| Trifluoroacetic Acid SCHEMBL2086300 | 0.77 | BACE1 (0.56) | BACE1CTSDBACE2KCNH2CYP11B1 | |
| SCHEMBL3549867 | 0.77 | BACE1 (0.69) | BACE1CTSDBACE2KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7855213-B2 | Compounds | ASTRAZENECA AB (SE) | 2010-12-21 | — | — | US | claimed |