Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 13/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1794196 | 0.84 | NPC1 (0.60) | GRM5NPC1RAB9AKDM4EHTT | |
| SCHEMBL1794106 | 0.82 | GRM5 (0.54) | GRM5NPC1RAB9A | |
| SCHEMBL1799227 | 0.81 | GRM5 (0.56) | GRM5NPC1RAB9AKDM4EHTT | |
| SCHEMBL1794131 | 0.78 | GRM5 (0.50) | GRM5NPC1RAB9AKDM4E | |
| SCHEMBL1794965 | 0.78 | GRM5 (0.50) | GRM5NPC1RAB9AKDM4E | |
| SCHEMBL1796852 | 0.77 | GRM5 (0.49) | GRM5NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL13055747 | 0.77 | NPC1 (0.45) | GRM5NPC1RAB9AKDM4EHTT | |
| SCHEMBL17379269 | 0.74 | GRM5 (0.81) | GRM5 | |
| SCHEMBL17379140 | 0.73 | GRM5 (1.00) | GRM5 | |
| SCHEMBL1795993 | 0.73 | MAPT (0.42) | GRM5NPC1RAB9AKDM4EHTT |
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-7951824-B2 | 4-aryl-pyridine-2-carboxyamide derivatives | HOFFMAN-LA ROCHE INC. (US) | 2011-05-31 | — | — | US | disclosed |