Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.58 |
| ▸ | PPARG | P37231 | 2/20 | 0.57 |
| ▸ | PPARA | Q07869 | 2/20 | 0.57 |
| ▸ | CNR1 | P21554 | 1/20 | 0.57 |
| ▸ | CNR2 | P34972 | 1/20 | 0.57 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.56 |
| ▸ | DHFR | P00374 | 6/20 | 0.53 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL17402430 | 0.98 | TSHR (0.63) | TSHRCYP2D6PPARGPPARACNR1 | |
| SCHEMBL14382693 | 0.95 | CYP2D6 (0.57) | TSHRCYP2D6PPARGPPARACNR1 | |
| SCHEMBL4568871 | 0.93 | PPARA (0.61) | TSHRCYP2D6PPARGPPARACNR1 | |
| SCHEMBL17509789 | 0.91 | PPARA (0.68) | TSHRCYP2D6PPARGPPARACNR1 | |
| SCHEMBL17509810 | 0.91 | PPARA (0.68) | TSHRCYP2D6PPARGPPARACNR1 | |
| SCHEMBL17509779 | 0.91 | PPARA (0.68) | TSHRCYP2D6PPARGPPARACNR1 | |
| SCHEMBL17509781 | 0.91 | PPARA (0.68) | TSHRCYP2D6PPARGPPARACNR1 | |
| SCHEMBL17509804 | 0.91 | PPARA (0.68) | TSHRCYP2D6PPARGPPARACNR1 | |
| SCHEMBL17509796 | 0.91 | PPARA (0.68) | TSHRCYP2D6PPARGPPARACNR1 | |
| SCHEMBL17509791 | 0.91 | PPARA (0.68) | TSHRCYP2D6PPARGPPARACNR1 |
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-2091955-A1 | ALKOXY COMPOUNDS FOR DISEASE TREATMENT | Acucela, Inc. (US) | 2009-08-26 | — | — | EP | disclosed |
| WO-2009045479-A1 | ALKOXY COMPOUNDS FOR DISEASE TREATMENT | ACUCELA INC. (US) | 2009-04-09 | — | — | WO | disclosed |