Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 6/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CPT1A | P50416 | 1/20 | 0.41 |
| ▸ | CPT1B | Q92523 | 1/20 | 0.41 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 4/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.38 |
| ▸ | CCR1 | P32246 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL1645218 | 0.91 | CPT1A (0.47) | PTGDR2CPT1ACPT1BPTGDRALDH1A1 | |
| SCHEMBL1643733 | 0.84 | LMNA (0.41) | CPT1ACPT1BALDH1A1MAPTKDM4E | |
| SCHEMBL1643513 | 0.80 | ALDH1A1 (0.43) | ALDH1A1KDM4EGAAL3MBTL1TSHR | |
| SCHEMBL1645115 | 0.79 | CPT1A (0.53) | PTGDR2SMN1; SMN2CPT1ACPT1BALDH1A1 | |
| SCHEMBL13760738 | 0.78 | HTT (0.40) | PTGDR2CPT1ACPT1BALDH1A1MAPT | |
| SCHEMBL1643720 | 0.78 | FAAH (0.44) | PTGDR2SMN1; SMN2ALDH1A1MAPTKDM4E | |
| SCHEMBL1644669 | 0.78 | PTGDR2 (0.48) | PTGDR2CPT1ACPT1BPTGDRL3MBTL1 | |
| SCHEMBL1643429 | 0.78 | PTGDR2 (0.48) | PTGDR2PTGDRCYP2C9 | |
| SCHEMBL1644063 | 0.77 | MAPT (0.51) | SMN1; SMN2ALDH1A1MAPTKDM4EGAA | |
| SCHEMBL1645540 | 0.76 | CYP3A4 (0.49) | PTGDR2SMN1; SMN2CPT1ACPT1BALDH1A1 |
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-2257536-A2 | CYCLIC DIARYL ETHER AS ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS | Amira Pharmaceuticals, Inc. (US) | 2010-12-08 | — | — | EP | disclosed |
| WO-2009102893-A2 | CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN D2 receptors | AMIRA PHARMACEUTICALS, INC. (US) | 2009-08-20 | — | — | WO | disclosed |