Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CG | P48736 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 8/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22809460 | 0.82 | ADORA3 (0.46) | ADORA3ADORA1ADORA2AADORA2BALDH1A1 | |
| SCHEMBL18266541 | 0.82 | ADORA3 (0.43) | ADORA3ADORA1ADORA2ALCKALDH1A1 | |
| SCHEMBL18266627 | 0.81 | HPGD (0.46) | ADORA3ADORA1ADORA2AALDH1A1 | |
| SCHEMBL50044 | 0.78 | LCK (0.60) | PIK3CGL3MBTL1ADORA3CYP1A2LCK | |
| SCHEMBL22809639 | 0.77 | ADORA3 (0.48) | ADORA3ADORA1ADORA2AALDH1A1SMN1; SMN2 | |
| SCHEMBL23998421 | 0.75 | PIK3CG (0.47) | PIK3CGL3MBTL1ADORA3CYP1A2CYP2C9 | |
| SCHEMBL16913955 | 0.75 | ADORA3 (0.50) | PIK3CGL3MBTL1ADORA3CYP1A2CYP2C9 | |
| SCHEMBL29383895 | 0.75 | PIK3CG (0.47) | PIK3CGL3MBTL1ADORA3CYP1A2CYP2C9 | |
| SCHEMBL13600103 | 0.75 | SRC (0.33) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL378339 | 0.74 | SRC (0.42) | CYP1A2CYP2C19APOBEC3GALDH1A1POLB |
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-3487839-B1 | AMIDE DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS | RAQUALIA PHARMA INC (JP) | 2020-12-23 | — | — | EP | disclosed |