Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | SDHB | P21912 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11904341 | 0.83 | SLC2A1 (0.42) | MEN1ESR1KMT2ASLC2A1SDHB | |
| SCHEMBL7071544 | 0.76 | LMNA (0.52) | MEN1ESR1GAAKMT2AESR2 | |
| SCHEMBL9872956 | 0.75 | GAA (0.46) | MEN1ESR1GAAKMT2AESR2 | |
| SCHEMBL11166946 | 0.74 | CYP2D6 (0.43) | MEN1ESR1KMT2ASLC2A1CYP1A2 | |
| SCHEMBL2790280 | 0.72 | ALDH1A1 (0.48) | ESR1CYP1A2NR1H2CYP2D6PTGS2 | |
| SCHEMBL1655812 | 0.70 | KCNH2 (0.49) | ESR1SLC2A1CYP1A2CYP2D6PTGS2 | |
| SCHEMBL6938149 | 0.70 | MEN1 (0.57) | MEN1ESR1GAAKMT2AESR2 | |
| SCHEMBL10698356 | 0.70 | CYP1A2 (0.41) | MEN1ESR1GAAKMT2AESR2 | |
| SCHEMBL1073454 | 0.69 | MEN1 (0.68) | MEN1ESR1GAAKMT2AESR2 | |
| SCHEMBL3843866 | 0.69 | LMNA (0.50) | MEN1ESR1GAAKMT2AESR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012107532-A1 | 4-AMINOALCOHOLQUINOLINE DERIVATIVES, ENANTIOSELECTIVE SYNTHESIS METHODS AND THE USE THEREOF | Université de Picardie Jules Verne (FR) | 2012-08-16 | — | — | WO | disclosed |
| EP-2487157-A1 | Enantioselective synthesis method of 4-aminoalcoholquinoline derivatives and the use | Université de Picardie Jules Verne (FR) | 2012-08-15 | — | — | EP | disclosed |