Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.35 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL473958 | 0.92 | ALDH1A1 (0.37) | POLBPTGER3USP30ALDH1A1GPR55 | |
| SCHEMBL474476 | 0.88 | MAPK14 (0.35) | POLBSMN1; SMN2PTGER3USP30MAPK14 | |
| SCHEMBL474611 | 0.88 | SMN1; SMN2 (0.35) | POLBSMN1; SMN2ALDH1A1MAPK14EGFR | |
| SCHEMBL474658 | 0.85 | SMN1; SMN2 (0.36) | POLBSMN1; SMN2ALDH1A1MAPK14EGFR | |
| SCHEMBL474431 | 0.84 | TRPV1 (0.41) | POLBALDH1A1CASP3 | |
| SCHEMBL474384 | 0.83 | GPR55 (0.36) | POLBSMN1; SMN2PTGER3USP30MAPK14 | |
| SCHEMBL12163834 | 0.83 | GPR55 (0.36) | POLBSMN1; SMN2PTGER3USP30MAPK14 | |
| SCHEMBL473989 | 0.82 | ALDH1A1 (0.37) | POLBPTGER3ALDH1A1GPR55L3MBTL1 | |
| SCHEMBL474455 | 0.80 | ALDH1A1 (0.34) | ALDH1A1MALT1 | |
| SCHEMBL474720 | 0.79 | PTGER3 (0.33) | POLBSMN1; SMN2PTGER3USP30ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2411365-A1 | 2,3-DIARYL- OR HETEROARYL-SUBSTITUTED 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2012-02-01 | — | — | EP | disclosed |