Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.35 |
| ▸ | KIT | P10721 | 1/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | KDM4A | O75164 | 1/20 | 0.33 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17128014 | 1.00 | CHRM2 (0.36) | CHRM2HRH4JAK1CHRM1MAPKAPK2 | |
| SCHEMBL17128173 | 0.92 | CHRM1 (0.42) | CHRM2HRH4CHRM1PARP1 | |
| SCHEMBL18436684 | 0.92 | CHRM1 (0.42) | CHRM2HRH4CHRM1PARP1 | |
| SCHEMBL17128117 | 0.91 | MEN1 (0.38) | CHRM2HRH4JAK1MAPKAPK2MEN1 | |
| SCHEMBL18436341 | 0.90 | CHRM2 (0.37) | CHRM2HRH4JAK1MAPKAPK2KIT | |
| SCHEMBL17127783 | 0.90 | CHRM2 (0.37) | CHRM2HRH4JAK1MAPKAPK2KIT | |
| SCHEMBL18436126 | 0.90 | CHRM2 (0.37) | CHRM2HRH4JAK1MAPKAPK2KIT | |
| SCHEMBL21336923 | 0.90 | CHRM2 (0.37) | CHRM2HRH4JAK1MAPKAPK2KIT | |
| SCHEMBL17128119 | 0.89 | CHRM2 (0.34) | CHRM2HRH4JAK1MAPKAPK2KIT | |
| SCHEMBL17127784 | 0.88 | SMO (0.41) | CHRM2HRH4JAK1MAPKAPK2KIT |
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-3124482-B1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) | 2019-09-11 | — | — | EP | disclosed |
| EP-3124482-A1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) | 2017-02-01 | — | — | EP | disclosed |