Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5A | P29375 | 4/20 | 0.56 |
| ▸ | KDM5C | P41229 | 1/20 | 0.56 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.56 |
| ▸ | PDE9A | O76083 | 10/20 | 0.50 |
| ▸ | TDO2 | P48775 | 2/20 | 0.43 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.41 |
| ▸ | PRKACA | P17612 | 1/20 | 0.41 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.41 |
| ▸ | NEK4 | P51957 | 1/20 | 0.41 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.41 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.41 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20870340 | 0.88 | KDM5A (0.56) | KDM5AKDM5CKDM5BPDE9ATDO2 | |
| SCHEMBL20870616 | 0.88 | KDM5A (0.59) | KDM5AKDM5CKDM5BPDE9APARP1 | |
| SCHEMBL22871683 | 0.87 | PDE9A (0.67) | KDM5AKDM5CKDM5BPDE9APARP1 | |
| SCHEMBL22298103 | 0.78 | KDM5A (0.69) | KDM5AKDM5CKDM5BPDE9APARP1 | |
| SCHEMBL24063492 | 0.76 | PDE9A (0.65) | PDE9APDE1CPARP1DHODH | |
| SCHEMBL22298186 | 0.76 | KDM5A (0.56) | KDM5AKDM5CKDM5BPDE9APARP1 | |
| SCHEMBL22871658 | 0.76 | KDM5A (0.75) | KDM5AKDM5CKDM5BPDE9ATDO2 | |
| SCHEMBL20870269 | 0.75 | KDM5A (0.57) | KDM5AKDM5CKDM5BPDE9APARP1 | |
| SCHEMBL20870607 | 0.74 | KDM5A (0.53) | KDM5AKDM5CKDM5BPDE9APARP1 | |
| SCHEMBL20870599 | 0.73 | KDM5A (0.55) | KDM5AKDM5CKDM5BPDE9APARP1 |
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-3689876-A1 | PDE9 INHIBITOR AND USE THEREOF | Nanjing Transthera Biosciences Co. Ltd. (CN) | 2020-08-05 | — | — | EP | disclosed |