Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | KDM5A | P29375 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.36 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 5/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| SCHEMBL26179840 | 0.92 | KDM5A (0.42) | KDM5AKDM4CKDM5BTLR7RORC | |
| SCHEMBL7031706 | 0.80 | KDM5A (0.39) | CYP3A4CYP2C9KDM5AKDM4CKDM5B | |
| SCHEMBL8390750 | 0.80 | KDM5A (0.39) | CYP3A4CYP2C9KDM5AKDM4CKDM5B | |
| SCHEMBL7032806 | 0.80 | KDM5A (0.39) | CYP2C9KDM5AKDM4CKDM5BTLR7 | |
| SCHEMBL7029268 | 0.80 | CYP2C9 (0.43) | CYP2C9KDM5AKDM4CKDM5BTLR7 | |
| SCHEMBL3902288 | 0.79 | ACMSD (0.41) | HTR1DCYP3A4CYP2C9APPDPP4 | |
| SCHEMBL3900939 | 0.79 | HTR1D (0.41) | HTR1DCYP3A4CYP2C9APPDPP4 | |
| SCHEMBL7732631 | 0.79 | EPHX2 (0.35) | HTR1DCYP3A4CYP2C9APPDPP4 | |
| SCHEMBL8385781 | 0.78 | KDM5A (0.37) | CYP3A4KDM5AKDM4CKDM5BTLR7 | |
| SCHEMBL8390577 | 0.78 | KDM5A (0.35) | KDM5AKDM4CKDM5BTLR7RORC |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012020643-A1 | COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | JNC株式会社 (JP) | 2012-02-16 | — | — | WO | disclosed |