Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 2/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.37 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 2/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 3/20 | 0.35 |
| ▸ | MAOB | P27338 | 3/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | MLYCD | O95822 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL6665292 | 0.91 | TSHR (0.43) | CYP2A6TSHRHSD17B10KIF11LOXL2 | |
| SCHEMBL6666748 | 0.88 | HSD17B10 (0.57) | CYP2A6TSHRHSD17B10KIF11CYP19A1 | |
| SCHEMBL6666031 | 0.83 | TAAR1 (0.37) | KIF11 | |
| SCHEMBL6662025 | 0.83 | TAAR1 (0.46) | KCNH2PPARDPPARAMAOBDAO | |
| SCHEMBL6667001 | 0.82 | L3MBTL1 (0.45) | — | |
| SCHEMBL6663192 | 0.81 | CYP2A6 (0.35) | CYP2A6KIF11 | |
| SCHEMBL6665018 | 0.80 | DAO (0.39) | CYP2A6KCNJ1KCNH2DAO | |
| SCHEMBL6666655 | 0.80 | ALDH1A1 (0.40) | CYP2A6TSHRHSD17B10MAOAMAOB | |
| SCHEMBL6666969 | 0.79 | FAAH (0.47) | HSD17B10 | |
| SCHEMBL6664946 | 0.79 | TSHR (0.42) | TSHRKIF11PPARDPPARAEPHX2 |
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-0893423-B1 | LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES | CHISSO CORP (JP) | 2004-09-01 | — | — | EP | disclosed |