Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA5 | P31644 | 14/20 | 0.51 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.46 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4971798 | 0.84 | ALDH1A1 (0.52) | GABRA5ALDH1A1PLA2G1BMAPTATG4B | |
| SCHEMBL4790252 | 0.83 | GABRA5 (0.49) | GABRA5THRBALDH1A1 | |
| SCHEMBL4723502 | 0.83 | ALDH1A1 (0.56) | GABRA5THRBALDH1A1PLA2G1BMAPT | |
| SCHEMBL1777407 | 0.82 | GABRA5 (0.51) | GABRA5THRBALDH1A1GPBAR1HTR7 | |
| SCHEMBL1777280 | 0.82 | GABRA5 (0.54) | GABRA5THRBALDH1A1GPBAR1HTR7 | |
| SCHEMBL27814863 | 0.82 | GABRA5 (0.51) | GABRA5THRBALDH1A1GPBAR1HTR7 | |
| SCHEMBL27814671 | 0.81 | GABRA5 (0.49) | GABRA5THRBALDH1A1GPBAR1 | |
| SCHEMBL27918192 | 0.80 | GABRA5 (0.55) | GABRA5THRBALDH1A1GPBAR1 | |
| SCHEMBL21752792 | 0.80 | GABRA5 (0.60) | GABRA5ALDH1A1GPBAR1 | |
| SCHEMBL21752799 | 0.79 | GPBAR1 (0.48) | GABRA5ALDH1A1GPBAR1HTR7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1968973-A2 | ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2008-09-17 | — | — | EP | disclosed |
| WO-2007074078-A2 | ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2007-07-05 | — | — | WO | disclosed |