Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | HPGDS | O60760 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.37 |
| ▸ | KDM4A | O75164 | 1/20 | 0.36 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.36 |
| ▸ | KIT | P10721 | 1/20 | 0.36 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | PRKDC | P78527 | 1/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | CTSA | P10619 | 1/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 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 | |
|---|---|---|---|---|
| SCHEMBL21336706 | 0.88 | ALDH1A1 (0.39) | HRH4HPGDSCYP11B2FYNIRAK4 | |
| SCHEMBL17128140 | 0.86 | HRH4 (0.44) | HRH4HPGDSCYP11B2FYNIRAK4 | |
| SCHEMBL17127609 | 0.86 | HRH4 (0.39) | HRH4HPGDSCYP11B2FYNIRAK4 | |
| SCHEMBL17127906 | 0.86 | HRH4 (0.39) | HRH4HPGDSCYP11B2FYNIRAK4 | |
| SCHEMBL17127785 | 0.84 | SQOR (0.41) | HRH4HPGDSCYP11B2FYNIRAK4 | |
| SCHEMBL17128379 | 0.84 | HRH4 (0.38) | HRH4HPGDSCYP11B2FYNIRAK4 | |
| SCHEMBL17128318 | 0.82 | BRS3 (0.43) | HRH4IRAK4KDM4AKDM5BSLC22A12 | |
| SCHEMBL17128200 | 0.81 | HRH4 (0.41) | HRH4HPGDSFYNIRAK4KDM4A | |
| SCHEMBL17128203 | 0.81 | IRAK4 (0.38) | HRH4HPGDSFYNIRAK4KDM4A | |
| SCHEMBL19001218 | 0.80 | MEN1 (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3124482-B1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) | 2019-09-11 | — | — | EP | disclosed |