Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | GMNN | O75496 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 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 | |
|---|---|---|---|---|
| SCHEMBL27589785 | 0.81 | ACHE (0.48) | CYP3A4EGFRERBB2ALDH1A1TRPA1 | |
| SCHEMBL6981682 | 0.81 | CYP19A1 (0.45) | PPARGPPARASLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL9985184 | 0.81 | CYP19A1 (0.42) | PPARGPPARACYP3A4ALDH1A1TRPA1 | |
| SCHEMBL27560189 | 0.81 | CYP19A1 (0.42) | PPARGPPARACYP3A4ALDH1A1TRPA1 | |
| SCHEMBL22089166 | 0.75 | PPARG (0.43) | PPARGPPARASLC6A4MAPTTHRB | |
| SCHEMBL13068253 | 0.73 | SLC6A2 (0.53) | PPARGPPARASLC6A4MAPTTHRB | |
| SCHEMBL8623135 | 0.73 | SLC6A2 (0.53) | PPARGPPARASLC6A4MAPTTHRB | |
| Hydrochloric Acid SCHEMBL3374296 | 0.71 | SLC6A2 (0.51) | PPARGPPARASLC6A4SLC6A2SLC6A3 | |
| SCHEMBL7490330 | 0.71 | CYP19A1 (0.45) | MAPT | |
| SCHEMBL7940630 | 0.71 | MAPT (0.53) | PPARGPPARAMAPTTHRBCNR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104812382-A | Substituted alkyl diaryl derivatives, preparation method and use | UNIV TEMPLE | 2015-07-29 | — | — | CN | claimed |
| CN-104812382-A | Substituted alkyl diaryl derivatives, preparation method and use | UNIV TEMPLE | 2015-07-29 | — | — | CN | disclosed |