Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | GFPT1 | Q06210 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 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 | |
|---|---|---|---|---|
| SCHEMBL847082 | 0.78 | HCAR2 (0.67) | HCAR2KEAP1NFE2L2NPSR1ATM | |
| Diethyl Maleate SCHEMBL28185444 | 0.78 | HCAR2 (0.67) | HCAR2KEAP1NFE2L2NPSR1ATM | |
| SCHEMBL554288 | 0.78 | HCAR2 (0.67) | HCAR2KEAP1NFE2L2NPSR1ATM | |
| Diethyl Maleate SCHEMBL28318001 | 0.78 | HCAR2 (0.67) | HCAR2KEAP1NFE2L2NPSR1ATM | |
| Diethyl Maleate SCHEMBL1997508 | 0.78 | HCAR2 (0.67) | HCAR2KEAP1NFE2L2NPSR1ATM | |
| SCHEMBL847081 | 0.78 | HCAR2 (0.67) | HCAR2KEAP1NFE2L2NPSR1ATM | |
| SCHEMBL10494399 | 0.77 | HCAR2 (0.55) | HCAR2KEAP1NFE2L2NPSR1ATM | |
| SCHEMBL10494406 | 0.77 | HCAR2 (0.55) | HCAR2KEAP1NFE2L2NPSR1ATM | |
| SCHEMBL1018102 | 0.77 | HCAR2 (0.43) | HCAR2KEAP1NFE2L2NPSR1ATM | |
| SCHEMBL26463483 | 0.75 | HCAR2 (0.50) | HCAR2KEAP1NFE2L2NPSR1ATM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008085119-A1 | NEW PYRIDINE ANALOGUES VIII 518 | ASTRAZENECA AB (SE) | 2008-07-17 | — | — | WO | disclosed |