Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM4 | P08173 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | HPGDS | O60760 | 1/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.46 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | CFD | P00746 | 2/20 | 0.44 |
| ▸ | CNR1 | P21554 | 2/20 | 0.44 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.44 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6863147 | 0.89 | CHRM4 (0.46) | CHRM4HTTHPGDSPDE4APDE4B | |
| SCHEMBL6863240 | 0.85 | CHRM4 (0.55) | CHRM4HTTHPGDSPDE4APDE4B | |
| SCHEMBL6873668 | 0.85 | CHRM4 (0.47) | CHRM4HTTHPGDSPDE4APDE4B | |
| SCHEMBL6872383 | 0.85 | ADORA2A (0.56) | CHRM4HPGDSPDE4APDE4BPDE4C | |
| SCHEMBL6868029 | 0.84 | CHRM4 (0.52) | CHRM4HTTHPGDSPDE4APDE4B | |
| SCHEMBL7708892 | 0.82 | FADS1 (0.43) | CHRM4HTTKDM4EMEN1ALDH1A1 | |
| SCHEMBL6868095 | 0.81 | KDM4E (0.53) | HTTCNR1KDM4EMEN1ALDH1A1 | |
| SCHEMBL7711667 | 0.76 | MAPK13 (0.43) | HTTCNR1MEN1KMT2A | |
| SCHEMBL6868100 | 0.75 | ADORA2A (0.44) | HTTKDM4EMEN1ALDH1A1HPGD | |
| SCHEMBL6870681 | 0.74 | ADORA2A (0.49) | HTTKDM4EMEN1ALDH1A1HPGD |
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 |