Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | ACVRL1 | P37023 | 4/20 | 0.35 |
| ▸ | AHCY | P23526 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALB | P02768 | 1/20 | 0.33 |
| ▸ | STING1 | Q86WV6 | 2/20 | 0.32 |
| ▸ | ADA | P00813 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.30 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.30 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.30 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | SLC28A1 | O00337 | 1/20 | 0.30 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.30 |
| ▸ | SLC28A2 | O43868 | 1/20 | 0.30 |
| ▸ | GAPDH | P04406 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15289753 | 1.00 | CYP2A6 (0.37) | CYP2A6ACVRL1AHCYMAPK1ALDH1A1 | |
| SCHEMBL18520482 | 1.00 | CYP2A6 (0.37) | CYP2A6ACVRL1AHCYMAPK1ALDH1A1 | |
| SCHEMBL21637014 | 0.83 | DNPH1 (0.38) | ADORA1SMN1; SMN2 | |
| SCHEMBL20324561 | 0.83 | STING1 (0.31) | STING1 | |
| SCHEMBL17106740 | 0.81 | ADRB1 (0.40) | MAPK1LMNASTING1ADORA3DPP4 | |
| SCHEMBL20324789 | 0.81 | STING1 (0.31) | ALDH1A1STING1ADORA1SMN1; SMN2 | |
| SCHEMBL20325339 | 0.81 | POLB (0.31) | ALDH1A1STING1ADORA1SMN1; SMN2 | |
| SCHEMBL18667150 | 0.81 | CYP2A6 (0.39) | CYP2A6ACVRL1MAPK1ALDH1A1LMNA | |
| SCHEMBL4970560 | 0.81 | CYP2A6 (0.39) | CYP2A6ACVRL1MAPK1ALDH1A1LMNA | |
| SCHEMBL19343962 | 0.81 | CYP2A6 (0.39) | CYP2A6ACVRL1MAPK1ALDH1A1LMNA |
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-3621624-B1 | CYCLIC DI-NUCLEOTIDE COMPOUNDS AS STING AGONISTS | MERCK SHARP & DOHME LLC (US) | 2023-08-30 | — | — | EP | disclosed |