Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | G6PD | P11413 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PDE5A | O76074 | 1/20 | 0.34 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.34 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.34 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.34 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2679932 | 0.84 | CYP2D6 (0.43) | CYP2D6SIGMAR1G6PDKEAP1NFE2L2 | |
| SCHEMBL30502409 | 0.84 | CYP2D6 (0.43) | CYP2D6SIGMAR1G6PDKEAP1NFE2L2 | |
| Hydrochloric Acid SCHEMBL28101819 | 0.83 | EP300 (0.43) | CYP2D6SIGMAR1G6PDMEN1GAA | |
| SCHEMBL9283373 | 0.78 | CYP2D6 (0.43) | CYP2D6G6PDKEAP1NFE2L2PKM | |
| SCHEMBL31040674 | 0.77 | CYP2D6 (0.40) | CYP2D6SIGMAR1KEAP1NFE2L2RAB9A | |
| Acetonitrile SCHEMBL28255271 | 0.77 | EP300 (0.38) | CYP2D6SIGMAR1RAB9AMEN1GAA | |
| SCHEMBL152855 | 0.72 | CYP2A6 (0.50) | CYP2D6G6PDMAPTHPGDCTRB1 | |
| SCHEMBL11782368 | 0.71 | CYP2D6 (0.39) | CYP2D6KEAP1NFE2L2PKMRAB9A | |
| SCHEMBL1414206 | 0.71 | SIGMAR1 (0.57) | CYP2D6SIGMAR1PDE5ACYP1A2CYP2C19 | |
| SCHEMBL41541 | 0.71 | CYP2D6 (0.53) | CYP2D6HCRTR1CTRB1CYP1A2CYP2C19 |
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-20060252060-A1 | Direct multiplex characterization of genomic DNA | WILLIS THOMAS D | 2006-11-09 | — | — | US | disclosed |