Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 16/20 | 0.60 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6871992 | 0.90 | ADORA2A (0.58) | ADORA2AALDH1A1HPGDLMNA | |
| SCHEMBL6871192 | 0.90 | ADORA2A (0.58) | ADORA2ALMNA | |
| SCHEMBL6873589 | 0.89 | ADORA2A (0.56) | ADORA2AKDM4EALDH1A1HPGDLMNA | |
| SCHEMBL6871493 | 0.88 | ADORA2A (0.66) | ADORA2AHPGDPLAU | |
| SCHEMBL6871404 | 0.88 | ADORA2A (0.51) | ADORA2AKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL6873996 | 0.85 | ADORA2A (0.55) | ADORA2AKDM4EALDH1A1HPGDLMNA | |
| SCHEMBL6868316 | 0.85 | ADORA2A (0.55) | ADORA2AKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL6867257 | 0.85 | ADORA2A (0.55) | ADORA2AALDH1A1HSD17B10 | |
| SCHEMBL6867554 | 0.85 | ADORA2A (0.63) | ADORA2AALDH1A1 | |
| SCHEMBL6873157 | 0.83 | HPGDS (0.51) | ADORA2AKDM4EALDH1A1HPGDHSD17B10 |
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-1347974-B1 | AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | disclosed |