Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.65 |
| ▸ | RAB9A | P51151 | 4/20 | 0.65 |
| ▸ | GRM5 | P41594 | 13/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | GCK | P35557 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1797460 | 0.88 | GRM5 (0.53) | NPC1RAB9AGRM5KDM4EGAA | |
| SCHEMBL1797781 | 0.85 | SMARCA2 (0.61) | NPC1RAB9AGRM5KDM4EGAA | |
| SCHEMBL1796144 | 0.83 | GRM5 (0.58) | NPC1RAB9AGRM5KDM4EGAA | |
| SCHEMBL1795907 | 0.83 | GRM5 (0.57) | NPC1RAB9AGRM5KDM4EGAA | |
| SCHEMBL1796690 | 0.82 | GRM5 (0.56) | NPC1RAB9AGRM5KDM4EGAA | |
| SCHEMBL1798244 | 0.82 | GRM5 (0.60) | NPC1RAB9AGRM5KDM4EGAA | |
| SCHEMBL1798000 | 0.81 | NPC1 (0.53) | NPC1RAB9AGRM5KDM4EGAA | |
| SCHEMBL1797792 | 0.81 | GRM5 (0.57) | NPC1RAB9AGRM5KDM4EGAA | |
| SCHEMBL1798452 | 0.81 | GRM5 (0.52) | NPC1RAB9AGRM5GCKMAPT | |
| SCHEMBL1796062 | 0.81 | GRM5 (0.60) | NPC1RAB9AGRM5 |
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 |
|---|---|---|---|---|---|---|---|
| US-7951824-B2 | 4-aryl-pyridine-2-carboxyamide derivatives | HOFFMAN-LA ROCHE INC. (US) | 2011-05-31 | — | — | US | claimed |
| US-7951824-B2 | 4-aryl-pyridine-2-carboxyamide derivatives | HOFFMAN-LA ROCHE INC. (US) | 2011-05-31 | — | — | US | disclosed |