Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4A | O75164 | 1/20 | 0.38 |
| ▸ | KDM4B | O94953 | 1/20 | 0.38 |
| ▸ | KDM5C | P41229 | 1/20 | 0.38 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL361247 | 0.77 | AKT2 (0.41) | KDM4AKDM4BKDM5CKDM5BADRA1D | |
| SCHEMBL28300532 | 0.73 | MAPK1 (0.50) | ADORA2AADORA2BALDH1A1KDM4AKDM4B | |
| SCHEMBL2788049 | 0.72 | CYP2A6 (0.44) | ALDH1A1KDM4ELMNAMAPTHTT | |
| SCHEMBL18209362 | 0.72 | ALDH1A1 (0.50) | ADORA2AADORA2BALDH1A1KDM4AKDM4B | |
| SCHEMBL952863 | 0.72 | NOTUM (0.48) | ADORA2AADORA2BALDH1A1KDM4AKDM4B | |
| SCHEMBL1924873 | 0.72 | ADORA2A (0.45) | ADORA2AADORA2BALDH1A1KDM4AKDM4B | |
| SCHEMBL12613954 | 0.72 | KDM4A (0.42) | ADORA2AADORA2BALDH1A1KDM4AKDM4B | |
| SCHEMBL2172238 | 0.72 | KDM4A (0.42) | ADORA2AADORA2BALDH1A1KDM4AKDM4B | |
| SCHEMBL20394404 | 0.72 | ADORA2A (0.45) | ADORA2AADORA2BALDH1A1KDM4AKDM4B | |
| SCHEMBL8671607 | 0.72 | KDM4A (0.42) | ADORA2AADORA2BALDH1A1KDM4AKDM4B |
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-2590946-A1 | BIPYRIDYL DERIVATIVES USEFUL FOR THE TREATMENT OF KINASE - INDUCED DISEASES | Merck Patent GmbH (DE) | 2013-05-15 | — | — | EP | disclosed |
| WO-2012003912-A1 | BIPYRIDYL DERIVATIVES USEFUL FOR THE TREATMENT OF KINASE - INDUCED DISEASES | MERCK PATENT GMBH (DE) | 2012-01-12 | — | — | WO | disclosed |