Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 8/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 7/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 7/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.38 |
| ▸ | PI4KA | P42356 | 3/20 | 0.38 |
| ▸ | PI4K2B | Q8TCG2 | 3/20 | 0.38 |
| ▸ | PI4K2A | Q9BTU6 | 3/20 | 0.38 |
| ▸ | PI4KB | Q9UBF8 | 3/20 | 0.38 |
| ▸ | RET | P07949 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8041250 | 0.78 | ADORA2A (0.64) | ADORA2AADORA3ADORA1ADORA2BPI4KA | |
| SCHEMBL8046656 | 0.77 | ADORA2A (0.44) | ADORA2AADORA3ADORA1ADORA2BCYP1A2 | |
| SCHEMBL8043040 | 0.77 | FBP1 (0.38) | ADORA2AADORA3ADORA1ADORA2BCYP1A2 | |
| SCHEMBL4958943 | 0.75 | FBP1 (0.53) | HSPA5 | |
| SCHEMBL8039378 | 0.75 | ADORA2A (0.47) | ADORA2AADORA3ADORA1ADORA2BPI4KA | |
| SCHEMBL5359008 | 0.64 | FBP1 (0.68) | ADORA2AADORA3ADORA1ADORA2BPI4KA | |
| SCHEMBL11406936 | 0.63 | HSPA8 (0.71) | SMN1; SMN2HSPA5 | |
| SCHEMBL11406951 | 0.63 | HSPA8 (0.71) | SMN1; SMN2HSPA5 | |
| SCHEMBL8049902 | 0.61 | RPS6KB1 (0.50) | — | |
| SCHEMBL20558598 | 0.61 | ADORA2A (0.52) | ADORA2AADORA3ADORA1ADORA2BPI4KA |
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 |