Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14193555 | 0.89 | CHRNB4 (0.41) | CHRNB4CHRNA3 | |
| SCHEMBL31575359 | 0.78 | CHRNB2 (0.43) | SLC6A3CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL31575321 | 0.78 | DPP4 (0.46) | CHRNB4CHRNA3 | |
| SCHEMBL31575334 | 0.78 | DPP4 (0.46) | CHRNB4CHRNA3 | |
| SCHEMBL31575348 | 0.78 | CHRNB2 (0.43) | SLC6A3CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL31575342 | 0.74 | DPP4 (0.45) | SLC6A3 | |
| SCHEMBL31575328 | 0.74 | SLC6A2 (0.44) | SLC6A3CHRNB2CHRNA4 | |
| SCHEMBL30166180 | 0.74 | SLC6A2 (0.44) | SLC6A3CHRNB2CHRNA4 | |
| SCHEMBL10082491 | 0.71 | CHRNA7 (0.50) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL23886115 | 0.71 | CHRNB4 (0.42) | CHRNB4CHRNA3CHRNB2CHRNA4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6316490-B1 | FOR THERAPY OF PARKINSON'S DISEASE, ALZHEIMER'S DISEASE, DEMENTIA, CONTROLLING PAIN | MERCK & CO., INC. | 2001-11-13 | — | — | US | disclosed |
| EP-0874818-A1 | NOVEL SUBSTITUTED ARYL COMPOUNDS USEFUL AS MODULATORS OF ACETYLCHOLINE RECEPTORS | SIBIA NEUROSCIENCES, INC. (US) | 1998-11-04 | — | — | EP | disclosed |
| WO-1997019059-A1 | NOVEL SUBSTITUTED ARYL COMPOUNDS USEFUL AS MODULATORS OF ACETYLCHOLINE RECEPTORS | SIBIA NEUROSCIENCES, INC. (US) | 1997-05-29 | — | — | WO | disclosed |