Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 1/20 | 0.44 |
| ▸ | GBA1 | P04062 | 1/20 | 0.42 |
| ▸ | PGK1 | P00558 | 1/20 | 0.42 |
| ▸ | PGK2 | P07205 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9105896 | 0.93 | FDPS (0.49) | FDPSGBA1PGK1PGK2RAB9A | |
| SCHEMBL17915603 | 0.79 | GBA1 (0.43) | FDPSGBA1RAB9ANPC1KDM4E | |
| SCHEMBL30563036 | 0.75 | GBA1 (0.41) | FDPSGBA1RAB9AKDM4EALDH1A1 | |
| SCHEMBL1106224 | 0.75 | GBA1 (0.41) | FDPSGBA1RAB9AKDM4EALDH1A1 | |
| SCHEMBL14769201 | 0.75 | PGK1 (0.47) | PGK1PGK2RAB9AKDM4E | |
| Hydrochloric Acid SCHEMBL2884959 | 0.74 | GBA1 (0.40) | FDPSGBA1RAB9AKDM4EALDH1A1 | |
| SCHEMBL19271839 | 0.74 | GBA1 (0.40) | FDPSGBA1RAB9ANPC1KDM4E | |
| SCHEMBL14769117 | 0.73 | PGK1 (0.48) | PGK1PGK2 | |
| SCHEMBL28327869 | 0.72 | FDPS (0.42) | FDPSGBA1RAB9ANPC1KDM4E | |
| SCHEMBL31729646 | 0.72 | GBA1 (0.52) | GBA1RAB9ANPC1KDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2046804-A1 | SYNTHESIS OF DIETHYL{ I5\" (3 -FLUOROPHENYL) -PYRIDINE-2-YL] METHYL} PHOSPHONATE USED IN THE SYNTHESIS OF HIMBACINE ANALOGS | SCHERING CORPORATION (US) | 2009-04-15 | — | — | EP | disclosed |
| WO-2008005348-A1 | SYNTHESIS OF DIETHYL{ I5' (3 -FLUOROPHENYL) -PYRIDINE-2-YL] METHYL} PHOSPHONATE USED IN THE SYNTHESIS OF HIMBACINE ANALOGS | SCHERING CORPORATION (US) | 2008-01-10 | — | — | WO | disclosed |