Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.39 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7931623 | 0.88 | KCNH2 (0.41) | MAPK1KCNH2 | |
| SCHEMBL7934901 | 0.88 | MAOB (0.40) | APPKCNH2 | |
| SCHEMBL7932222 | 0.87 | DRD2 (0.43) | APPSMN1; SMN2MEN1KMT2AKCNH2 | |
| SCHEMBL9804553 | 0.77 | NQO1 (0.39) | ALDH1A1SMN1; SMN2MEN1LMNAMAPK1 | |
| SCHEMBL7930430 | 0.76 | KCNH2 (0.43) | KCNH2 | |
| SCHEMBL7922514 | 0.76 | NQO1 (0.50) | ALDH1A1SMN1; SMN2MEN1LMNAKMT2A | |
| SCHEMBL7931627 | 0.75 | CETP (0.49) | — | |
| SCHEMBL9804313 | 0.74 | SLC5A2 (0.40) | MEN1LMNAMAPK1KMT2ASIGMAR1 | |
| SCHEMBL407786 | 0.74 | LTA4H (0.41) | MEN1LMNAKMT2ASIGMAR1 | |
| SCHEMBL19113684 | 0.70 | APP (0.58) | APPALDH1A1SMN1; SMN2MEN1USP2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |