Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 6/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.34 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.34 |
| ▸ | HPGDS | O60760 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL8214679 | 0.90 | P2RX3 (0.44) | P2RX3RAB9AKDM4ENPC1L3MBTL1 | |
| SCHEMBL12934504 | 0.88 | RAB9A (0.44) | P2RX3RAB9AKDM4ENPC1L3MBTL1 | |
| SCHEMBL29716162 | 0.86 | P2RX3 (0.46) | P2RX3RAB9AKDM4ENPC1L3MBTL1 | |
| SCHEMBL13395392 | 0.86 | P2RX3 (0.46) | P2RX3RAB9AKDM4ENPC1L3MBTL1 | |
| SCHEMBL29991790 | 0.85 | P2RX3 (0.49) | P2RX3RAB9AKDM4ENPC1L3MBTL1 | |
| SCHEMBL29992438 | 0.85 | P2RX3 (0.44) | P2RX3RAB9AKDM4ENPC1L3MBTL1 | |
| SCHEMBL29991596 | 0.85 | P2RX3 (0.48) | P2RX3RAB9AKDM4ENPC1L3MBTL1 | |
| SCHEMBL14730353 | 0.85 | P2RX3 (0.48) | P2RX3RAB9AKDM4ENPC1L3MBTL1 | |
| SCHEMBL15987117 | 0.85 | P2RX3 (0.48) | P2RX3RAB9AKDM4ENPC1L3MBTL1 | |
| SCHEMBL6864274 | 0.85 | P2RX3 (0.48) | P2RX3RAB9AKDM4ENPC1L3MBTL1 |
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-2008057208-A2 | HCV NS3 PROTEASE INHIBITORS | MERCK & CO., INC. (US) | 2008-05-15 | — | — | WO | disclosed |