Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | PSMD10 | O75832 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11258848 | 0.99 | CA12 (0.40) | CA12CA9CA2PLA2G2CCA1 | |
| SCHEMBL9146743 | 0.94 | CA12 (0.41) | CA12CA9CA2CA1PSMD10 | |
| SCHEMBL10345660 | 0.94 | CA12 (0.41) | CA12CA9CA2CA1PSMD10 | |
| SCHEMBL8143786 | 0.94 | CA12 (0.41) | CA12CA9CA2CA1PSMD10 | |
| SCHEMBL10398217 | 0.90 | PLA2G2C (0.42) | CA12CA9CA2PLA2G2CCA1 | |
| SCHEMBL8984191 | 0.90 | CA12 (0.44) | CA12CA9CA2PLA2G2CCA1 | |
| SCHEMBL4574543 | 0.88 | CA12 (0.43) | CA12CA9CA2CA1ALDH1A1 | |
| SCHEMBL9486162 | 0.88 | CA12 (0.43) | CA12CA9CA2CA1ALDH1A1 | |
| SCHEMBL3086878 | 0.87 | CA12 (0.40) | CA12CA9CA2PLA2G2CCA1 | |
| SCHEMBL29215677 | 0.87 | CA12 (0.40) | CA12CA9CA2PLA2G2CCA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0339252-B1 | 2,5-disubstituted pyrazine derivatives, pyrimidine derivatives, and liquid crystal containing the same | DAINIPPON INK & CHEMICALS (JP) | 1996-06-12 | — | — | EP | disclosed |
| US-5128472-A | Electrooptical display materials, ferroelectric display | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1992-07-07 | — | — | US | disclosed |
| US-4997942-A | 2,4-disubstituted pyrazine derivatives, pyrimidine derivatives, and liquid crystal containing the same | DAINIPPON INK AND CHEMICAL, INC. (JP) | 1991-03-05 | — | — | US | disclosed |
| EP-0339252-A2 | 2,5-disubstituted pyrazine derivatives, pyrimidine derivatives, and liquid crystal containing the same | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1989-11-02 | — | — | EP | disclosed |