Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5160351 | 0.82 | EPHX2 (0.46) | ALDH1A1ALOX15SMN1; SMN2NPC1MAPT | |
| SCHEMBL5160138 | 0.79 | ALDH1A1 (0.44) | ALDH1A1ALOX15SMN1; SMN2NPC1MAPT | |
| SCHEMBL5158167 | 0.78 | ALDH1A1 (0.46) | ALDH1A1ALOX15SMN1; SMN2NPC1MAPT | |
| SCHEMBL5159890 | 0.74 | ALDH1A1 (0.41) | ALDH1A1ALOX15SMN1; SMN2NPC1MAPT | |
| SCHEMBL29221815 | 0.69 | KMT2A (0.61) | ALDH1A1ALOX15SMN1; SMN2NPC1MAPT | |
| SCHEMBL15559955 | 0.67 | MEN1 (0.48) | MAPTMAPK1KDM4EPOLBHDAC1 | |
| SCHEMBL23069543 | 0.67 | TDP1 (0.61) | ALDH1A1NPC1MAPTRAB9AKDM4E | |
| SCHEMBL5162886 | 0.66 | ALDH1A1 (0.60) | ALDH1A1ALOX15SMN1; SMN2NPC1MAPT | |
| SCHEMBL30503476 | 0.66 | CTSK (0.43) | NPC1MAPTRAB9AGAAPOLB | |
| SCHEMBL29079457 | 0.65 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2NPC1MAPTMAPK1 |
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-1753733-A1 | SMALL MOLECULES FOR TREATMENT OF HYPERCHOLESTEROLEMIA AND RELATED DISEASES | Avanir Pharmaceuticals (US) | 2007-02-21 | — | — | EP | disclosed |
| WO-2005123700-A1 | SMALL MOLECULES FOR TREATMENT OF HYPERCHOLESTEROLEMIA AND RELATED DISEASES | AVANIR PHARMACEUTICALS (US) | 2005-12-29 | — | — | WO | disclosed |