Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ATR | Q13535 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.45 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1794822 | 0.91 | GRM4 (0.54) | GRM4NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL1792836 | 0.86 | ATR (0.59) | GRM4NPC1RAB9ASMN1; SMN2ATR | |
| SCHEMBL1795347 | 0.85 | CYP1A2 (0.48) | GRM4NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL1792907 | 0.85 | CYP1A2 (0.48) | NPC1RAB9ASMN1; SMN2ALDH1A1SCN10A | |
| SCHEMBL1798210 | 0.82 | HSD17B10 (0.51) | NPC1RAB9ASMN1; SMN2ALDH1A1TP53 | |
| SCHEMBL1795787 | 0.82 | SMN1; SMN2 (0.52) | NPC1RAB9ASMN1; SMN2ALDH1A1SCN10A | |
| SCHEMBL1798303 | 0.81 | GRM4 (0.62) | GRM4NPC1RAB9ASMN1; SMN2ATR | |
| SCHEMBL1793853 | 0.80 | CYP1A2 (0.50) | CYP1A2CYP2C9GRM5CYP3A4 | |
| SCHEMBL1798156 | 0.78 | CYP1A2 (0.48) | CYP1A2CYP2C9GRM5KCNH2CYP3A4 | |
| SCHEMBL1794776 | 0.78 | LRRK2 (0.47) | GRM4SCN10ASCN2AGRM5KCNH2 |
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 |