Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 12/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 11/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 8/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 7/20 | 0.44 |
| ▸ | PI4KA | P42356 | 3/20 | 0.40 |
| ▸ | PI4K2B | Q8TCG2 | 3/20 | 0.40 |
| ▸ | PI4K2A | Q9BTU6 | 3/20 | 0.40 |
| ▸ | PI4KB | Q9UBF8 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PDE8B | O95263 | 1/20 | 0.37 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8039378 | 0.88 | ADORA2A (0.47) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL8041250 | 0.81 | ADORA2A (0.64) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL8039416 | 0.77 | ADORA2A (0.41) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL8043040 | 0.74 | FBP1 (0.38) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL4956730 | 0.72 | FBP1 (0.56) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL16707341 | 0.68 | ADORA2A (0.63) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL4956734 | 0.63 | FBP1 (0.53) | ADORA2AADORA1ADORA2BADORA3 | |
| SCHEMBL18510391 | 0.62 | ADORA2A (0.67) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL5732265 | 0.62 | ADORA2A (0.69) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL13587323 | 0.62 | ADORA2A (0.47) | ADORA2AADORA1ADORA2BADORA3PI4KA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1060182-A2 | NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS | Metabasis Therapeutics, Inc. (US) | 2000-12-20 | — | — | EP | disclosed |
| WO-1999045016-A2 | NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS | METABASIS THERAPEUTICS, INC. (US) | 1999-09-10 | — | — | WO | disclosed |