Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | CTSC | P53634 | 2/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | TOP1 | P11387 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 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 | |
|---|---|---|---|---|
| SCHEMBL27837269 | 0.73 | LTA4H (0.47) | ALDH1A1LTA4HKIF11KDM4EPTGS2 | |
| SCHEMBL4812690 | 0.72 | MAPT (0.42) | NPC1ALDH1A1GAALTA4HKDM4E | |
| SCHEMBL4811487 | 0.72 | NPC1 (0.42) | NPC1ALDH1A1GAALTA4HKDM4E | |
| SCHEMBL6615363 | 0.70 | PPARD (0.43) | GAAKIF11MAOB | |
| SCHEMBL148957 | 0.69 | NPC1 (0.46) | NPC1ALDH1A1GAALTA4HKIF11 | |
| SCHEMBL4683039 | 0.68 | NPC1 (0.48) | NPC1ALDH1A1GAAMAPTPTGS2 | |
| SCHEMBL5004933 | 0.66 | GHSR (0.38) | NPC1ALDH1A1GAAKIF11L3MBTL1 | |
| SCHEMBL6222041 | 0.66 | NPC1 (0.40) | NPC1ALDH1A1GAALTA4HKIF11 | |
| SCHEMBL2289309 | 0.64 | KIF11 (0.56) | CTSCKIF11TOP1CYP17A1CYP11B1 | |
| SCHEMBL9357255 | 0.61 | TAAR1 (0.56) | NPC1ALDH1A1LTA4HMAPTPTGS2 |
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-1349843-A1 | THIAZOLE AND OXAZOLE DERIVATIVES AS ACTIVATORS OF HUMAN PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS | GLAXO GROUP LIMITED (GB) | 2003-10-08 | — | — | EP | disclosed |
| WO-2002059098-A1 | THIAZOLE AND OXAZOLE DERIVATIVES AS ACTIVATORS OF HUMAN PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS | GLAXO GROUP LIMITED (GB) | 2002-08-01 | — | — | WO | disclosed |