Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | PPARD | Q03181 | 2/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | VEGFA | P15692 | 1/20 | 0.38 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.36 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.36 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.36 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.36 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.36 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2122196 | 0.89 | PIK3C3 (0.37) | MAPTL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL10112242 | 0.88 | MAPT (0.39) | BRD4MAPTL3MBTL1ALDH1A1HTR6 | |
| SCHEMBL16336240 | 0.79 | MAPT (0.41) | BRD4MAPTL3MBTL1PTGS2ALDH1A1 | |
| SCHEMBL2121103 | 0.73 | PIK3C3 (0.38) | BRD4MAPTL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL13003407 | 0.72 | PPARG (0.43) | PPARGPPARDPPARAVEGFAEGLN1 | |
| SCHEMBL2125502 | 0.72 | ALOX5 (0.39) | PPARGPPARDPPARAVEGFAEGLN1 | |
| SCHEMBL2121064 | 0.72 | ALDH1A1 (0.38) | MAPTL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL2128330 | 0.69 | ALDH1A1 (0.38) | VEGFAEGLN1MAPTL3MBTL1ALDH1A1 | |
| SCHEMBL2124356 | 0.69 | ALDH1A1 (0.38) | MAPTL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL10104277 | 0.69 | DPP4 (0.36) | BRD4MAPTL3MBTL1ALDH1A1HTR6 |
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-2443111-A1 | 1,2,4-OXADIAZOL DERIVATIVES, THEIR PHARMACEUTICAL COMPOSITIONS AND THEIR USE AS SPHINGOSINE 1-PHOSPHATE 1 RECEPTOR AGONISTS | Glaxo Group Limited (GB) | 2012-04-25 | — | — | EP | disclosed |
| WO-2010145203-A1 | 1,2,4-OXADIAZOL DERIVATIVES, THEIR PHARMACEUTICAL COMPOSITIONS AND THEIR USE AS SPHINGOSINE 1-PHOSPHATE 1 RECEPTOR AGONISTS | GLAXO GROUP LIMITED (GB) | 2010-12-23 | — | — | WO | disclosed |