Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.52 |
| ▸ | RAB9A | P51151 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | GRM5 | P41594 | 8/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | PYGL | P06737 | 1/20 | 0.47 |
| ▸ | GCK | P35557 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1793269 | 0.84 | GRM5 (0.56) | NPC1RAB9AKDM4EGAAMAPT | |
| SCHEMBL1793676 | 0.83 | MAPT (0.51) | NPC1RAB9AMAPTGRM5CYP3A4 | |
| SCHEMBL1792969 | 0.81 | GRM5 (0.43) | NPC1RAB9AKDM4EMAPTGRM5 | |
| SCHEMBL1795201 | 0.81 | GRM5 (0.59) | NPC1RAB9AKDM4EGAAMAPT | |
| SCHEMBL1797543 | 0.75 | GRM5 (0.49) | NPC1RAB9AGRM5KMT2AMEN1 | |
| SCHEMBL1796690 | 0.75 | GRM5 (0.56) | NPC1RAB9AKDM4EGAAMAPT | |
| SCHEMBL1797501 | 0.74 | GCK (0.57) | NPC1RAB9AMAPTGRM5KMT2A | |
| SCHEMBL1793317 | 0.74 | NPC1 (0.53) | NPC1RAB9AKDM4EGAAGRM5 | |
| SCHEMBL1797295 | 0.74 | GRM5 (0.53) | NPC1RAB9AMAPTGRM5CYP3A4 | |
| SCHEMBL4778199 | 0.73 | KMO (0.57) | — |
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 |