Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | KAT2B | Q92831 | 4/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | TYK2 | P29597 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | TERT | O14746 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | TOP2A | P11388 | 1/20 | 0.33 |
| ▸ | KDM4A | O75164 | 2/20 | 0.33 |
| ▸ | KDM4B | O94953 | 2/20 | 0.33 |
| ▸ | KDM5C | P41229 | 2/20 | 0.33 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MPO | P05164 | 1/20 | 0.32 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22216158 | 0.75 | PARP1 (0.37) | JAK2KDM4AKDM4BKDM5BKDM4E | |
| SCHEMBL20155565 | 0.73 | CNR2 (0.37) | CNR2KAT2BTERTTOP2AKDM4A | |
| SCHEMBL20155112 | 0.72 | ADORA3 (0.52) | MPO | |
| SCHEMBL27186089 | 0.70 | KDM4E (0.35) | KDM4EALDH1A1HPGD | |
| SCHEMBL22206944 | 0.70 | CCNK (0.45) | ALDH1A1DAO | |
| SCHEMBL20155016 | 0.70 | CNR2 (0.38) | CNR2KDM5BPDE4DHTR6 | |
| SCHEMBL5861345 | 0.69 | ALDH1A1 (0.49) | CNR2ALDH1A1SMN1; SMN2PDE4DDRD2 | |
| SCHEMBL20155613 | 0.68 | PARP1 (0.38) | KDM4EALDH1A1HPGDDAOSMN1; SMN2 | |
| SCHEMBL24035859 | 0.68 | PARP1 (0.34) | JAK2JAK1CHEK1KDM4EALDH1A1 | |
| SCHEMBL20155518 | 0.68 | KDM4E (0.36) | JAK2KDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018086604-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |