Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.41 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4248652 | 0.85 | NQO1 (0.67) | NQO1MAPTL3MBTL1RAB9ASIGMAR1 | |
| SCHEMBL7930472 | 0.84 | MAOB (0.41) | MAPTLTA4HALDH1A1CALM1 | |
| SCHEMBL6650023 | 0.84 | ALDH1A1 (0.57) | RAB9ALMNALTA4HKMT2AALDH1A1 | |
| SCHEMBL6652134 | 0.84 | ALDH1A1 (0.57) | RAB9ALMNALTA4HKMT2AALDH1A1 | |
| SCHEMBL10575040 | 0.83 | NQO1 (0.64) | NQO1MAPTL3MBTL1RAB9ASIGMAR1 | |
| SCHEMBL19197282 | 0.82 | ALDH1A1 (0.58) | LMNAKMT2AALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL20151741 | 0.81 | LMNA (0.50) | L3MBTL1LMNALTA4HKMT2AALDH1A1 | |
| SCHEMBL6652305 | 0.81 | CALM1 (0.58) | L3MBTL1SIGMAR1TDP1ALDH1A1CALM1 | |
| SCHEMBL7784549 | 0.80 | CYP3A4 (0.52) | MAPTL3MBTL1RAB9ALMNATSHR | |
| SCHEMBL7793413 | 0.80 | CYP3A4 (0.52) | MAPTL3MBTL1RAB9ALMNATSHR |
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 |