Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 9/20 | 0.35 |
| ▸ | PPARA | Q07869 | 9/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.32 |
| ▸ | CHRNG | P07510 | 1/20 | 0.32 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24749565 | 0.81 | CYP2C9 (0.34) | PPARGPPARACYP2C9CYP2C19CYP1A2 | |
| SCHEMBL10135905 | 0.79 | CA12 (0.48) | PPARGPPARACYP2C9CYP2C19CYP1A2 | |
| SCHEMBL17740696 | 0.79 | CA12 (0.48) | PPARGPPARACYP2C9CYP2C19CYP1A2 | |
| SCHEMBL14490044 | 0.79 | CA12 (0.48) | PPARGPPARACYP2C9CYP2C19CYP1A2 | |
| SCHEMBL26009396 | 0.79 | CA12 (0.48) | PPARGPPARACYP2C9CYP2C19CYP1A2 | |
| SCHEMBL10135919 | 0.79 | CA12 (0.48) | PPARGPPARACYP2C9CYP2C19CYP1A2 | |
| SCHEMBL18069078 | 0.78 | CA12 (0.47) | PPARGPPARACYP2C9CYP2C19CYP1A2 | |
| SCHEMBL20837363 | 0.77 | ALOX5 (0.32) | — | |
| SCHEMBL27269990 | 0.77 | CA12 (0.46) | PPARGPPARACYP2C9CYP2C19CYP1A2 | |
| SCHEMBL17465494 | 0.77 | CA12 (0.44) | PPARGPPARACYP2C9CYP2C19CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1950194-A1 | AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME | Idemitsu Kosan Co., Ltd. (JP) | 2008-07-30 | — | — | EP | disclosed |