Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.52 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PLAT | P00750 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6867557 | 0.91 | ADORA2A (0.46) | ADORA2AGAAHPGDPARP1HDAC1 | |
| SCHEMBL6867481 | 0.90 | ADORA2A (0.51) | ADORA2AMAPTKDM4EALDH1A1LMNA | |
| SCHEMBL6867466 | 0.87 | ADORA2A (0.49) | ADORA2AKDM4EALDH1A1HPGD | |
| SCHEMBL6863726 | 0.82 | ADORA2A (0.56) | ADORA2APPARGMAPTKDM4EALDH1A1 | |
| SCHEMBL6871681 | 0.80 | ADORA2A (0.51) | ADORA2AMAPTKDM4EALDH1A1LMNA | |
| SCHEMBL6870601 | 0.80 | ADORA2A (0.65) | ADORA2AMAPTKDM4EALDH1A1LMNA | |
| SCHEMBL6870657 | 0.80 | ADORA2A (0.50) | ADORA2APPARGMAPTKDM4EALDH1A1 | |
| SCHEMBL6872091 | 0.80 | ADORA2A (0.82) | ADORA2A | |
| SCHEMBL6866841 | 0.79 | ADORA2A (0.55) | ADORA2AKDM4EALDH1A1LMNAHPGD | |
| SCHEMBL6870143 | 0.78 | ADORA2A (0.65) | ADORA2AMAPTKDM4EALDH1A1LMNA |
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 |