Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.46 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 2/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.38 |
| ▸ | ICMT | O60725 | 2/20 | 0.37 |
| ▸ | LTA4H | P09960 | 2/20 | 0.37 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.37 |
| ▸ | IGF1R | P08069 | 1/20 | 0.37 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6017333 | 0.91 | TRPV1 (0.48) | TRPV1HCRTR2PPARDPPARGPPARA | |
| SCHEMBL6017371 | 0.89 | TRPV1 (0.45) | TRPV1HCRTR2MAOBTRPM8PKM | |
| SCHEMBL6017118 | 0.85 | PKM (0.38) | TRPV1MAOBTRPM8PKMPPARD | |
| SCHEMBL6017387 | 0.85 | TRPV1 (0.40) | TRPV1HCRTR2MAOBTRPM8PKM | |
| SCHEMBL5617133 | 0.80 | KDM4E (0.48) | TRPV1PPARDPPARGPPARAICMT | |
| SCHEMBL6218951 | 0.79 | PPARG (0.51) | PPARDPPARGPPARA | |
| SCHEMBL6017580 | 0.79 | MAOB (0.40) | TRPV1MAOBPKMPPARDPPARA | |
| SCHEMBL6219446 | 0.79 | PPARA (0.59) | PPARDPPARGPPARA | |
| SCHEMBL6029277 | 0.78 | PPARD (0.51) | MAOBPPARDPPARGPPARAGSTP1 | |
| SCHEMBL6220042 | 0.78 | PPARD (0.49) | TRPV1TRPM8PKMPPARDPPARG |
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-1682535-A1 | HETEROARYL DERIVATIVES AS PPAR ACTIVATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-07-26 | — | — | EP | disclosed |
| WO-2005049606-A1 | HETEROARYL DERIVATIVES AS PPAR ACTIVATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-06-02 | — | — | WO | disclosed |