Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MET | P08581 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28663481 | 0.86 | HPGD (0.52) | HPGDALDH1A1CYP11B2SMN1; SMN2GAA | |
| SCHEMBL29424821 | 0.83 | HPGD (0.37) | METHPGDGAAADORA2A | |
| SCHEMBL22533657 | 0.83 | HPGD (0.37) | METHPGDGAAADORA2A | |
| SCHEMBL6665170 | 0.80 | MET (0.42) | METKDM4EHPGDALDH1A1CYP11B2 | |
| SCHEMBL6661754 | 0.79 | ADORA2A (0.56) | METKDM4EALDH1A1CYP11B2HTT | |
| SCHEMBL29434725 | 0.74 | ALDH1A1 (0.52) | METKDM4EHPGDALDH1A1CYP11B2 | |
| SCHEMBL20187539 | 0.74 | ALDH1A1 (0.52) | METKDM4EHPGDALDH1A1CYP11B2 | |
| SCHEMBL22221944 | 0.74 | ADORA2A (0.62) | ADORA2A | |
| SCHEMBL21883518 | 0.72 | MET (0.46) | METKDM4EHPGDALDH1A1CYP11B2 | |
| SCHEMBL30021455 | 0.72 | MET (0.46) | METKDM4EHPGDALDH1A1CYP11B2 |
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-1444982-A1 | The use of purine derivatives as selective kinase inhibitors | MERCKLE GMBH (DE) | 2004-08-11 | — | — | EP | disclosed |