Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | ALPG | P10696 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6817097 | 0.95 | CHRNB2 (0.39) | CHRNB2CHRNA7CHRNA4GAAALPG | |
| SCHEMBL6817247 | 0.87 | CHRNA4 (0.32) | CHRNB2CHRNA7CHRNA4 | |
| SCHEMBL6919182 | 0.86 | CHRNA7 (0.33) | CHRNB2CHRNA7CHRNA4 | |
| SCHEMBL6820640 | 0.78 | — | — | |
| SCHEMBL6817792 | 0.75 | CHRNA7 (0.32) | CHRNA7 | |
| SCHEMBL6817171 | 0.72 | CHRNB2 (0.32) | CHRNB2CHRNA7CHRNA4 | |
| SCHEMBL6917992 | 0.71 | CHRNB2 (0.36) | CHRNB2CHRNA7CHRNA4GAAALPG | |
| SCHEMBL6917989 | 0.71 | CHRNB2 (0.36) | CHRNB2CHRNA7CHRNA4GAAALPG | |
| SCHEMBL6920211 | 0.71 | CHRNB2 (0.36) | CHRNB2CHRNA7CHRNA4GAAALPG | |
| SCHEMBL6912174 | 0.69 | ALDH1A1 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004009599-A1 | FIVE-MEMBERED HETEROAROMATIC OLEFINIC AZACYCLIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS INHIBITORS OF NCOTINIC CHOLINERGIC RECEPTORS | TARGACEPT, INC. (US) | 2004-01-29 | — | — | WO | claimed |
| WO-2004009599-A1 | FIVE-MEMBERED HETEROAROMATIC OLEFINIC AZACYCLIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS INHIBITORS OF NCOTINIC CHOLINERGIC RECEPTORS | TARGACEPT, INC. (US) | 2004-01-29 | — | — | WO | disclosed |