Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA4 | P43681 | 7/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.32 |
| ▸ | TRPC6 | Q9Y210 | 2/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.32 |
| ▸ | VNN1 | O95497 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25958496 | 0.81 | TRPC6 (0.39) | TRPC6 | |
| SCHEMBL25958444 | 0.79 | CNR1 (0.43) | DPP4HPGDALDH1A1TRPC6 | |
| SCHEMBL25958594 | 0.77 | SCN9A (0.40) | TRPC6 | |
| SCHEMBL25958476 | 0.75 | DPP4 (0.32) | DPP4TRPC6 | |
| SCHEMBL25958553 | 0.75 | VNN1 (0.43) | DPP4HPGDALDH1A1VNN1 | |
| SCHEMBL25958544 | 0.74 | VNN1 (0.39) | TRPC6VNN1 | |
| SCHEMBL25958460 | 0.73 | SMN1; SMN2 (0.46) | HPGDALDH1A1VNN1 | |
| SCHEMBL25958568 | 0.69 | SMN1; SMN2 (0.37) | HPGDVNN1 | |
| SCHEMBL24086956 | 0.68 | CHRNA4 (0.40) | CHRNA4DPP4CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL25958516 | 0.68 | TRPC6 (0.38) | ALDH1A1TRPC6VNN1 |
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-3870582-B1 | 5-AZAINDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS | MERCK PATENT GMBH (DE) | 2023-07-19 | — | — | EP | disclosed |