Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6871570 | 0.92 | HPGD (0.46) | TP53MAPTHPGDGAAHDAC1 | |
| SCHEMBL6867499 | 0.87 | KMT2A (0.43) | MAPTHDAC1ALDH1A1CYP3A4LMNA | |
| SCHEMBL6870466 | 0.87 | TP53 (0.47) | TP53MAPTHPGDGAAKDM4E | |
| SCHEMBL6867448 | 0.86 | HTT (0.56) | TP53MAPTHPGDGAAHDAC1 | |
| SCHEMBL6869820 | 0.86 | KDM4E (0.44) | TP53MAPTHPGDKDM4EALDH1A1 | |
| SCHEMBL6863351 | 0.85 | PLAU (0.47) | TP53MAPTHPGDHDAC1KDM4E | |
| SCHEMBL6872927 | 0.84 | TP53 (0.46) | TP53MAPTHPGDGAAHDAC1 | |
| SCHEMBL6873996 | 0.83 | ADORA2A (0.55) | TP53MAPTHPGDGAAHDAC1 | |
| SCHEMBL6863761 | 0.83 | HPGD (0.46) | TP53MAPTHPGDGAAHDAC1 | |
| SCHEMBL7114944 | 0.83 | ADORA2A (0.54) | TP53MAPTHPGDGAAHDAC1 |
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 |