Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 13/20 | 0.52 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | TACR2 | P21452 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SHBG | P04278 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6666958 | 0.95 | SPHK1 (0.46) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL6663775 | 0.95 | SPHK1 (0.52) | SPHK1SPHK2CYP2C9ESR1ADRA2A | |
| SCHEMBL6660741 | 0.95 | SPHK1 (0.44) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL6661887 | 0.93 | CYP2C9 (0.44) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL6667375 | 0.93 | CYP2C9 (0.44) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL6667716 | 0.92 | SPHK1 (0.41) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL6660749 | 0.92 | SPHK1 (0.41) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL6664255 | 0.91 | SPHK1 (0.40) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL6662845 | 0.91 | SPHK1 (0.40) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL6666563 | 0.89 | SPHK1 (0.42) | SPHK1SPHK2CYP2C9ALDH1A1LMNA |
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 |