Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 8/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4242263 | 0.85 | SMN1; SMN2 (0.35) | PPARAALDH1A1SMN1; SMN2MEN1GAA | |
| SCHEMBL4240216 | 0.80 | KEAP1 (0.38) | DAOALDH1A1KEAP1NFE2L2RAB9A | |
| SCHEMBL28781533 | 0.80 | KEAP1 (0.38) | DAOALDH1A1KEAP1NFE2L2RAB9A | |
| SCHEMBL4250166 | 0.80 | KEAP1 (0.38) | DAOALDH1A1KEAP1NFE2L2RAB9A | |
| SCHEMBL4249237 | 0.76 | CHRM3 (0.60) | MEN1KMT2ACHRM3CHRM2CHRM4 | |
| SCHEMBL13701475 | 0.76 | CHRM3 (0.60) | MEN1KMT2ACHRM3CHRM2CHRM4 | |
| SCHEMBL4243567 | 0.76 | CHRM3 (0.46) | ALDH1A1MEN1KMT2ACHRM3CHRM2 | |
| Iodide SCHEMBL4251867 | 0.75 | CHRM3 (0.58) | CHRM3CHRM2CHRM4CHRM1 | |
| SCHEMBL10746836 | 0.72 | PPARA (0.50) | PPARADAOALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL4243224 | 0.71 | CHRM3 (0.44) | ALDH1A1KEAP1NFE2L2MEN1GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-101490003-A | New alkyl esters of cyclic amino alcohols with muscarinic m3 receptor antagonist activity, useful for treating e.g. chronic bronchial obstruction, asthma and overactive bladder | ASTRAZENECA AB (SE) | 2009-07-22 | — | — | CN | disclosed |