Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.34 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | BCL9 | O00512 | 1/20 | 0.34 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL14815848 | 1.00 | MCHR1 (0.35) | MCHR1SCN3AGBA1KDM4ECNR1 | |
| SCHEMBL15462540 | 0.93 | SCN3A (0.37) | SCN3AKDM4ECNR1HSD11B1L3MBTL1 | |
| SCHEMBL20328479 | 0.93 | SCN3A (0.34) | MCHR1SCN3AKDM4ECNR1HSD11B1 | |
| SCHEMBL14816060 | 0.93 | SCN3A (0.37) | SCN3AKDM4ECNR1HSD11B1L3MBTL1 | |
| SCHEMBL14816159 | 0.92 | KDM4E (0.43) | SCN3AKDM4ECNR1HSD11B1L3MBTL1 | |
| SCHEMBL14815759 | 0.92 | KDM4E (0.43) | SCN3AKDM4ECNR1HSD11B1L3MBTL1 | |
| SCHEMBL14816165 | 0.92 | KDM4E (0.43) | SCN3AKDM4ECNR1HSD11B1L3MBTL1 | |
| SCHEMBL14815957 | 0.92 | KDM4E (0.43) | SCN3AKDM4ECNR1HSD11B1L3MBTL1 | |
| SCHEMBL14815899 | 0.90 | HSD11B1 (0.44) | MCHR1HSD11B1GAA | |
| SCHEMBL14815916 | 0.90 | HSD11B1 (0.44) | MCHR1HSD11B1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-8648074-B2 | Substituted octahydropyrrolo[1,2-a]pyrazine sulfonamides as calcium channel blockers | ABBVIE INC. (US) | 2014-02-11 | — | — | US | claimed |