Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CETP | P11597 | 11/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7931692 | 0.88 | LTA4H (0.47) | ALDH1A1LMNASMN1; SMN2CETPLTA4H | |
| SCHEMBL27254251 | 0.81 | AOC3 (0.42) | LMNAMEN1CYP2D6KMT2A | |
| SCHEMBL8094239 | 0.81 | AOC3 (0.42) | LMNAMEN1CYP2D6KMT2A | |
| SCHEMBL27254426 | 0.81 | AOC3 (0.42) | LMNAMEN1CYP2D6KMT2A | |
| SCHEMBL9804659 | 0.79 | LTA4H (0.49) | PTGS1ALDH1A1CETPMEN1CYP2D6 | |
| SCHEMBL27629422 | 0.78 | PTGS1 (0.55) | PTGS1ALDH1A1LMNASMN1; SMN2MEN1 | |
| SCHEMBL14402624 | 0.77 | PTGS1 (0.54) | PTGS1ALDH1A1LMNASMN1; SMN2CETP | |
| SCHEMBL13850053 | 0.77 | PTGS1 (0.54) | PTGS1ALDH1A1LMNASMN1; SMN2CETP | |
| SCHEMBL7931678 | 0.76 | AOC3 (0.39) | — | |
| SCHEMBL7930475 | 0.76 | FDFT1 (0.52) | CETP |
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 |
|---|---|---|---|---|---|---|---|
| US-RE37087-E1 | 1-(4-ETHOXYPHENYL)-4-(4-FLUORO-3-PHENOXYPHENYL)-1 -TRIFLUOROMETHYLBUTANE OR 1-(4-ETHOXY-3-FLUOROPHENYL)-4-(3-PHENOXYPHENYL)-1-TRIFLUOROMETHYLBUTANE, FOR EXAMPLE; COMBATS INSECTS AND MITES | SCHERING AKTIENGESELLSCHAFT (DE) | 2001-03-06 | — | — | US | disclosed |
| EP-0390228-A2 | Chemical intermediates | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-10-03 | — | — | EP | disclosed |