Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.44 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.44 |
| ▸ | CHRNA1 | P02708 | 5/20 | 0.41 |
| ▸ | CHRNB1 | P11230 | 5/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 5/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 5/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.41 |
| ▸ | CHRNG | P07510 | 4/20 | 0.41 |
| ▸ | CHRND | Q07001 | 4/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6569199 | 0.81 | CHRNA1 (0.34) | CHRNA1CHRNB1CHRNB2SLC6A2CHRNB4 | |
| SCHEMBL6567191 | 0.78 | ALDH1A1 (0.39) | CHRNA1CHRNB1CHRNB2SLC6A2CHRNB4 | |
| SCHEMBL3162352 | 0.76 | TSHR (0.38) | KDM1AKDM1BCHRNA1CHRNB1CHRNB2 | |
| SCHEMBL6567176 | 0.72 | CHRNA1 (0.30) | CHRNA1CHRNB1CHRNB2SLC6A2CHRNB4 | |
| SCHEMBL6569281 | 0.72 | CHRNA1 (0.30) | CHRNA1CHRNB1CHRNB2SLC6A2CHRNB4 | |
| SCHEMBL6451585 | 0.70 | CHRNA1 (0.31) | CHRNA1CHRNB1CHRNB2SLC6A2CHRNB4 | |
| SCHEMBL12609563 | 0.70 | KDM1A (0.55) | KDM1AKDM1BALDH1A1 | |
| SCHEMBL12609570 | 0.70 | KDM1A (0.55) | KDM1AKDM1BALDH1A1 | |
| SCHEMBL509469 | 0.68 | KDM1A (0.53) | KDM1AKDM1BALDH1A1LMNA | |
| SCHEMBL30409263 | 0.68 | KDM1A (0.53) | KDM1AKDM1BALDH1A1LMNA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0919536-B1 | Fluorine-substituted 4-alkenylbenzoic acid and derivatives thereof, and nematic liquid crystal composition containing cyanophenyl benzoate derivatives and liquid crystal display system using the same | DAINIPPON INK & CHEMICALS (JP) | 2004-04-07 | — | — | EP | disclosed |
| US-6693223-B1 | STRONG POLAR COMPOUND HAVING LARGE DIELECTRIC ANISOTROPY; EXERTS EXCELLENT THRESHOLD VOLTAGE REDUCING EFFECT; EXCELLENT MISCIBILITY WITH CONVENTIONAL LIQUID CRYSTAL MATERIALS | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2004-02-17 | — | — | US | disclosed |
| US-20020053659-A1 | Fluorine-substituted-4-alkenylbenzoic acid and derivatives thereof, and nematic liquid crystal composition containing cyanophenyl benzoate derivatives and liquid crystal display system using the same | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2002-05-09 | — | — | US | disclosed |
| US-6287646-B1 | MIXTURES | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2001-09-11 | — | — | US | disclosed |
| EP-0919536-A1 | Fluorine-substituted 4-alkenylbenzoic acid and derivatives thereof, and nematic liquid crystal composition containing cyanophenyl benzoate derivatives and liquid crystal display system using the same | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1999-06-02 | — | — | EP | disclosed |