Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.56 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.44 |
| ▸ | PI4KA | P42356 | 1/20 | 0.43 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.43 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.43 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | MET | P08581 | 2/20 | 0.41 |
| ▸ | NSD2 | O96028 | 1/20 | 0.41 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | TEK | Q02763 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | QPCT | Q16769 | 2/20 | 0.39 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4343213 | 0.85 | ADORA2A (0.60) | ADORA2APIK3CDPI4KAPI4K2BPI4K2A | |
| SCHEMBL6665170 | 0.84 | MET (0.42) | ADORA2AMETHTTSMN1; SMN2LMNA | |
| SCHEMBL22533303 | 0.82 | ADORA2A (0.52) | ADORA2APIK3CDPI4KAPI4K2BPI4K2A | |
| SCHEMBL29424717 | 0.82 | ADORA2A (0.52) | ADORA2APIK3CDPI4KAPI4K2BPI4K2A | |
| Hydrochloric Acid SCHEMBL29424851 | 0.81 | ADORA2A (0.51) | ADORA2APIK3CDPI4KAPI4K2BPI4K2A | |
| Hydrochloric Acid SCHEMBL22533583 | 0.81 | ADORA2A (0.51) | ADORA2APIK3CDPI4KAPI4K2BPI4K2A | |
| SCHEMBL6662357 | 0.79 | MET (0.47) | ADORA2AMETHTTSMN1; SMN2CYP11B2 | |
| SCHEMBL6659204 | 0.77 | ADORA2A (0.74) | ADORA2API4KAPI4K2BPI4K2API4KB | |
| SCHEMBL1665392 | 0.74 | ADORA2A (0.71) | ADORA2APIK3CDPI4KAPI4K2BPI4K2A | |
| SCHEMBL21121650 | 0.73 | ADORA2A (0.40) | ADORA2API4KAPI4K2BPI4K2API4KB |
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 |