Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31395446 | 0.80 | PPARG (0.40) | PPARGPPARAENPP2NFE2L2SLC6A2 | |
| SCHEMBL1828620 | 0.80 | PPARG (0.40) | PPARGPPARAENPP2NFE2L2SLC6A2 | |
| SCHEMBL28194677 | 0.79 | PPARG (0.39) | PPARGPPARAENPP2NFE2L2SLC6A2 | |
| SCHEMBL31296095 | 0.76 | MGLL (0.44) | MRGPRX4 | |
| SCHEMBL28185685 | 0.76 | PPARG (0.39) | PPARGPPARANFE2L2SLC6A2SLC6A4 | |
| SCHEMBL27924989 | 0.76 | ORAI1 (0.39) | NFE2L2CES2CES1ALDH1A1NR4A2 | |
| SCHEMBL19746310 | 0.76 | CA1 (0.40) | ENPP2ALDH1A1 | |
| SCHEMBL2163061 | 0.76 | NFE2L2 (0.41) | PPARGPPARANFE2L2SLC6A2SLC6A4 | |
| SCHEMBL28016694 | 0.74 | PNMT (0.43) | ENPP2ALDH1A1 | |
| SCHEMBL28783953 | 0.73 | CA1 (0.41) | SLC6A2SLC6A4SLC6A3MEN1ALDH1A1 |
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-111032648-A | Organic triazine-containing molecules, in particular for optoelectronic devices | 辛诺拉有限公司 | 2020-04-17 | — | — | CN | disclosed |
| CN-108473462-A | Pyrazoles-pyridine derivate as EAAT3 inhibitor | 豪夫迈·罗氏有限公司 | 2018-08-31 | — | — | CN | disclosed |