Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.33 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.33 |
| ▸ | TTK | P33981 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 3/20 | 0.32 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.32 |
| ▸ | TYK2 | P29597 | 4/20 | 0.31 |
| ▸ | JAK1 | P23458 | 1/20 | 0.31 |
| ▸ | STAT3 | P40763 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | KDM4A | O75164 | 1/20 | 0.31 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | SGK1 | O00141 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21336578 | 0.88 | TTK (0.32) | NTRK1NTRK3NTRK2TTKSLC22A12 | |
| SCHEMBL18436403 | 0.87 | EGLN1 (0.34) | SLC22A12MAPK14EGLN1 | |
| SCHEMBL18436267 | 0.86 | DPP4 (0.34) | DPP4SLC22A12CNR2KDM4AKDM5B | |
| SCHEMBL18436867 | 0.86 | ENPP1 (0.34) | NTRK1NTRK3NTRK2TTKTYK2 | |
| SCHEMBL18436916 | 0.85 | DPP4 (0.34) | DPP4KDM1A | |
| SCHEMBL18436758 | 0.84 | KDM1A (0.34) | NTRK1NTRK3NTRK2TYK2MAPK1 | |
| SCHEMBL21336708 | 0.83 | HTR1A (0.36) | SLC22A12STAT3KDM4AKDM5BHTR1A | |
| SCHEMBL18436682 | 0.81 | RAD52 (0.38) | SLC22A12STAT3KDM4AKDM5BHTR1A | |
| SCHEMBL18436729 | 0.81 | CD274 (0.43) | KDM4AKDM5BMAPK1EGLN1 | |
| SCHEMBL18436930 | 0.79 | POLB (0.39) | CNR2KDM4AKDM5BHTR1AEGLN1 |
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 |