Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | LTA4H | P09960 | 4/20 | 0.56 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.52 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6625519 | 1.00 | HRH3 (0.57) | HRH3NPC1RAB9ALTA4HEPHX2 | |
| SCHEMBL11559799 | 0.87 | CCR5 (0.55) | OPRM1 | |
| SCHEMBL11559798 | 0.87 | CCR5 (0.55) | OPRM1 | |
| SCHEMBL11559870 | 0.87 | CCR5 (0.55) | OPRM1 | |
| SCHEMBL11559805 | 0.87 | CCR5 (0.55) | OPRM1 | |
| SCHEMBL11559861 | 0.87 | CCR5 (0.55) | OPRM1 | |
| SCHEMBL3069231 | 0.80 | NPC1 (0.52) | HRH3NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL16897870 | 0.79 | NPC1 (0.51) | HRH3NPC1RAB9AKDM4EGRIN1 | |
| SCHEMBL16897945 | 0.79 | NPC1 (0.51) | HRH3NPC1RAB9AKDM4EGRIN1 | |
| SCHEMBL6951299 | 0.78 | NPC1 (0.50) | HRH3NPC1RAB9AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0979824-B1 | Process for the preparation of substituted piperidine-epoxides | HOFFMANN LA ROCHE (CH) | 2004-10-06 | — | — | EP | claimed |