Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 2/20 | 0.37 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | GPR3 | P46089 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7930468 | 0.85 | HTT (0.40) | MAOBALDH1A1MAPTFFAR1MGLL | |
| SCHEMBL7922518 | 0.84 | NQO1 (0.48) | ALDH1A1MAPTCALM1LTA4H | |
| SCHEMBL18678028 | 0.83 | ALDH1A1 (0.54) | ALDH1A1MAPTMGLL | |
| SCHEMBL21467385 | 0.82 | SMN1; SMN2 (0.45) | MAOBALDH1A1MAPT | |
| SCHEMBL6652134 | 0.79 | ALDH1A1 (0.57) | ALDH1A1LTA4H | |
| SCHEMBL6650023 | 0.79 | ALDH1A1 (0.57) | ALDH1A1LTA4H | |
| SCHEMBL6652305 | 0.79 | CALM1 (0.58) | MAOBALDH1A1CALM1MMP2MMP9 | |
| SCHEMBL498377 | 0.78 | ALDH1A1 (0.56) | MAOBALDH1A1MAPTPIK3CDPIK3CA | |
| SCHEMBL21033436 | 0.78 | ALDH1A1 (0.45) | MAOBALDH1A1MAPT | |
| SCHEMBL8874083 | 0.78 | PPARA (0.45) | MAOBALDH1A1MAPTFFAR1PIK3CD |
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 |