Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.39 |
| ▸ | SHBG | P04278 | 1/20 | 0.37 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.32 |
| ▸ | HTR1D | P28221 | 1/20 | 0.32 |
| ▸ | HTR1B | P28222 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1860671 | 0.86 | CYP2C9 (0.43) | GABRA1GABRB2CYP2C9CYP2C19HIF1A | |
| SCHEMBL3636222 | 0.80 | CA2 (0.45) | GABRA1GABRB2KLF10CYP2C9CYP2C19 | |
| SCHEMBL29539350 | 0.80 | CA2 (0.45) | GABRA1GABRB2KLF10CYP2C9CYP2C19 | |
| SCHEMBL22380040 | 0.78 | HDAC3 (0.35) | KLF10SMN1; SMN2MAPK1 | |
| SCHEMBL394653 | 0.78 | GABRA1 (0.48) | GABRA1GABRB2CYP2C9CYP2C19HIF1A | |
| SCHEMBL31597226 | 0.78 | GABRA1 (0.48) | GABRA1GABRB2CYP2C9CYP2C19HIF1A | |
| SCHEMBL28375571 | 0.78 | TYR (0.44) | GABRA1GABRB2CYP2C9CYP2D6ALDH1A1 | |
| SCHEMBL7391020 | 0.75 | GABRA1 (0.33) | GABRA1GABRB2CYP2C9CYP2C19HIF1A | |
| SCHEMBL6611287 | 0.75 | NPSR1 (0.49) | ALDH1A1MEN1CYP3A4KMT2ANPSR1 | |
| SCHEMBL932105 | 0.75 | KLF10 (0.47) | KLF10CYP2C9HIF1AHSD17B10CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2084142-A2 | ALKYLATED HETEROCYCLIC REACTION PRODUCTS USEFUL AS ANTIOXIDANTS | Albermarle Corporation (US) | 2009-08-05 | — | — | EP | disclosed |
| WO-2008048988-A2 | ALKYLATED HETEROCYCLIC REACTION PRODUCTS USEFUL AS ANTIOXIDANTS | ALBEMARLE CORPORATION (US) | 2008-04-24 | — | — | WO | disclosed |