Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.43 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 2/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL1515277 | 1.00 | NFKB1 (0.50) | NFKB1NFKB2RELABTKGAA | |
| SCHEMBL5202686 | 1.00 | NFKB1 (0.50) | NFKB1NFKB2RELABTKGAA | |
| SCHEMBL1927425 | 0.95 | NFKB1 (0.51) | NFKB1NFKB2RELABTKGAA | |
| SCHEMBL1928948 | 0.90 | NFKB1 (0.56) | NFKB1NFKB2RELABTKGAA | |
| SCHEMBL18024827 | 0.83 | NFKB1 (0.50) | NFKB1NFKB2RELABTKGAA | |
| SCHEMBL4680638 | 0.82 | MAPT (0.40) | EPHX1KMT2AEPHX2 | |
| SCHEMBL19258039 | 0.79 | NFKB1 (0.53) | NFKB1NFKB2RELABTKGAA | |
| SCHEMBL27476940 | 0.78 | NFKB1 (0.59) | NFKB1NFKB2RELABTKGAA | |
| SCHEMBL18024837 | 0.78 | NFKB1 (0.51) | NFKB1NFKB2RELABTKGAA | |
| SCHEMBL27635798 | 0.78 | NFKB1 (0.48) | NFKB1NFKB2RELABTKGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1448177-A1 | AMINO DIOLS USEFUL IN THE TREATMENT OF ALZHEIMER'S DISEASE | Elan Pharmaceuticals, Inc. (US) | 2004-08-25 | — | — | EP | claimed |
| WO-2003043618-A2 | AMINO DIOLS USEFUL IN THE TREATMENT OF ALZHEIMER'S DISEASE | ELAN PHARMACEUTICALS, INC. (US) | 2003-05-30 | — | — | WO | claimed |
| CN-101356156-A | Aspartic protease inhibitors | VITAE PHARMACEUTICALS INC (US) | 2009-01-28 | — | — | CN | disclosed |