Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.50 |
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16728162 | 0.95 | MAPT (0.49) | CES2CES1MAPTLMNAMEN1 | |
| SCHEMBL16728116 | 0.89 | MAPT (0.51) | CES2CES1MAPTLMNAMEN1 | |
| SCHEMBL24158280 | 0.85 | MAPT (0.47) | MAPTLMNAMEN1NPC1KMT2A | |
| SCHEMBL24451168 | 0.84 | SMN1; SMN2 (0.49) | MAPTTBXAS1MEN1NPC1KMT2A | |
| SCHEMBL6524082 | 0.83 | MAPT (0.50) | CES2CES1MAPTLMNAMEN1 | |
| SCHEMBL16728092 | 0.83 | CES2 (0.57) | CES2CES1TBXAS1LMNANAAA | |
| SCHEMBL30040031 | 0.83 | MAPT (0.50) | CES2CES1MAPTLMNAMEN1 | |
| SCHEMBL6524085 | 0.83 | MAPT (0.50) | CES2CES1MAPTLMNAMEN1 | |
| SCHEMBL16728096 | 0.83 | CES2 (0.57) | CES2CES1TBXAS1LMNANAAA | |
| SCHEMBL28271477 | 0.83 | CES2 (0.57) | CES2CES1TBXAS1LMNANAAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015073140-A1 | 1,3,4-ALKENYL OXADIAZOLE AMINO ACID DERIVATIVES AS SPHINGOSINE-1-PHOSPHATE RECEPTORS' MODULATORS | ALLERGAN, INC. (US) | 2015-05-21 | — | — | WO | disclosed |