Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9458795 | 0.98 | CHRM5 (0.42) | CHRNA7CHRM5ADRA2C | |
| SCHEMBL9458901 | 0.83 | CHRNA7 (0.40) | CHRNA7 | |
| SCHEMBL9459185 | 0.74 | CHRM5 (0.42) | CHRNA7CHRM5ADRA2C | |
| SCHEMBL9459772 | 0.74 | CHRM5 (0.42) | CHRNA7CHRM5ADRA2C | |
| Hydrochloric Acid SCHEMBL9279446 | 0.71 | CHRNA7 (0.41) | CHRNA7 | |
| SCHEMBL9459170 | 0.68 | CHRNA7 (0.40) | CHRNA7 | |
| SCHEMBL28168581 | 0.63 | CHRNA7 (0.36) | CHRNA7 | |
| SCHEMBL861535 | 0.61 | CHRM5 (0.62) | CHRM5ADRA2C | |
| SCHEMBL2681656 | 0.61 | CHRM5 (0.62) | CHRM5ADRA2C | |
| SCHEMBL861534 | 0.61 | CHRM5 (0.62) | CHRM5ADRA2C |
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 |
|---|---|---|---|---|---|---|---|
| US-5273972-A | [(2-diakylaminomethyl)-3-quinuclidinyl]-benzamides and benzoates | A. H. ROBINS COMPANY, INCORPORATED (US) | 1993-12-28 | — | — | US | disclosed |
| US-5232920-A | For treating hypertension and congestive heart failure in mammals | SCHERING CORPORATION (US) | 1993-08-03 | — | — | US | disclosed |