Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM4 | P08173 | 4/20 | 0.48 |
| ▸ | POLQ | O75417 | 1/20 | 0.44 |
| ▸ | CSNK2A1 | P68400 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CLK1 | P49759 | 1/20 | 0.41 |
| ▸ | CLK2 | P49760 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20702376 | 1.00 | CHRM4 (0.48) | CHRM4POLQCSNK2A1SMN1; SMN2ALDH1A1 | |
| SCHEMBL20705299 | 0.91 | CHRM4 (0.48) | CHRM4POLQCSNK2A1SMN1; SMN2ALDH1A1 | |
| SCHEMBL30127887 | 0.91 | CHRM4 (0.48) | CHRM4POLQCSNK2A1SMN1; SMN2ALDH1A1 | |
| SCHEMBL20702388 | 0.91 | CSNK2A1 (0.46) | POLQCSNK2A1SMN1; SMN2ALDH1A1TP53 | |
| SCHEMBL22027634 | 0.85 | ADORA2A (0.44) | POLQCSNK2A1SMN1; SMN2ALDH1A1TP53 | |
| SCHEMBL30127873 | 0.85 | ADORA2A (0.44) | POLQCSNK2A1SMN1; SMN2ALDH1A1TP53 | |
| SCHEMBL24713254 | 0.82 | ADORA1 (0.44) | CHRM4DUSP3ADORA2AADORA2BADORA1 | |
| SCHEMBL22063533 | 0.82 | ADORA2A (0.50) | CHRM4SMN1; SMN2ALDH1A1ADORA2AADORA2B | |
| SCHEMBL20702441 | 0.82 | POLQ (0.47) | POLQCSNK2A1SMN1; SMN2ALDH1A1TP53 | |
| SCHEMBL20702421 | 0.81 | ADORA1 (0.47) | SMN1; SMN2ALDH1A1DUSP3ADORA2AADORA2B |
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-3661941-B1 | THIAZOLOPYRIDINE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS | MERCK PATENT GMBH (DE) | 2022-12-14 | — | — | EP | claimed |