Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.47 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL1792907 | 0.89 | CYP1A2 (0.48) | CYP1A2CYP2C9SMN1; SMN2CYP3A4SCN10A | |
| SCHEMBL1795610 | 0.86 | SMN1; SMN2 (0.51) | SMN1; SMN2ALDH1A1KMT2AL3MBTL1GRM4 | |
| SCHEMBL1798210 | 0.86 | HSD17B10 (0.51) | CYP1A2CYP2C9SMN1; SMN2CYP3A4ALDH1A1 | |
| SCHEMBL1797133 | 0.85 | GRM4 (0.49) | CYP1A2CYP2C9SMN1; SMN2CYP3A4SCN2A | |
| SCHEMBL1795787 | 0.85 | SMN1; SMN2 (0.52) | CYP1A2CYP2C9SMN1; SMN2CYP3A4SCN10A | |
| SCHEMBL1798156 | 0.84 | CYP1A2 (0.48) | CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL1793853 | 0.83 | CYP1A2 (0.50) | CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL1796965 | 0.80 | CYP3A4 (0.70) | CYP1A2CYP2C9SMN1; SMN2CYP3A4ALDH1A1 | |
| SCHEMBL7900424 | 0.78 | ALDH1A1 (0.59) | SMN1; SMN2ALDH1A1KMT2AL3MBTL1GRM4 | |
| SCHEMBL30761123 | 0.78 | CYP1A2 (0.69) | CYP1A2CYP2C9CYP3A4 |
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 |