Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 7/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | PDE2A | O00408 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.31 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6663001 | 0.90 | ALDH1A1 (0.33) | CASRAKR1C3AKR1C2ALDH1A1PDE2A | |
| SCHEMBL6665748 | 0.90 | TAAR1 (0.33) | CASRAKR1C3AKR1C2ALDH1A1PDE2A | |
| SCHEMBL6661194 | 0.86 | HTR2A (0.36) | ALDH1A1LMNATRPV1ADRA2CHTR2A | |
| SCHEMBL6664134 | 0.85 | ALDH1A1 (0.35) | CASRAKR1C3AKR1C2ALDH1A1PDE2A | |
| SCHEMBL6664057 | 0.84 | CASR (0.33) | CASRALDH1A1PDE2ALMNA | |
| SCHEMBL6667081 | 0.84 | FFAR1 (0.38) | CASRAKR1C3AKR1C2PDE2A | |
| SCHEMBL6661343 | 0.83 | PDE4A (0.30) | — | |
| SCHEMBL6663195 | 0.83 | CYP2A6 (0.34) | — | |
| SCHEMBL6662033 | 0.81 | ALDH1A1 (0.42) | CASRALDH1A1PDE2ALMNA | |
| SCHEMBL6667003 | 0.80 | LMNA (0.46) | CASRALDH1A1LMNATACR1 |
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 |