Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 4/20 | 1.00 |
| ▸ | CHRNA4 | P43681 | 4/20 | 1.00 |
| ▸ | CHRNA7 | P36544 | 3/20 | 1.00 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 1.00 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.39 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13589890 | 1.00 | CHRNB2 (1.00) | CHRNB2CHRNA4CHRNA7ALDH1A1CHRNA3 | |
| SCHEMBL21307962 | 1.00 | CHRNB2 (1.00) | CHRNB2CHRNA4CHRNA7ALDH1A1CHRNA3 | |
| SCHEMBL160708 | 1.00 | CHRNB2 (1.00) | CHRNB2CHRNA4CHRNA7ALDH1A1CHRNA3 | |
| Fumaric Acid SCHEMBL29615612 | 0.91 | CHRNB2 (0.82) | CHRNB2CHRNA4CHRNA7ALDH1A1CHRNA3 | |
| Trifluoroacetic Acid SCHEMBL397542 | 0.89 | CHRNB2 (0.80) | CHRNB2CHRNA4CHRNA7ALDH1A1CHRNA3 | |
| SCHEMBL21308152 | 0.82 | CHRNB2 (0.70) | CHRNB2CHRNA4CHRNA7ALDH1A1CHRNA3 | |
| SCHEMBL30534203 | 0.81 | CHRNB2 (0.69) | CHRNB2CHRNA4CHRNA7ALDH1A1CHRNA3 | |
| SCHEMBL12102742 | 0.81 | CHRNB2 (0.69) | CHRNB2CHRNA4CHRNA7ALDH1A1CHRNA3 | |
| Trifluoroacetic Acid SCHEMBL16431875 | 0.74 | CHRNB2 (0.57) | CHRNB2CHRNA4CHRNA7ALDH1A1CHRNA3 | |
| SCHEMBL25658 | 0.67 | CHRNA7 (0.71) | CHRNB2CHRNA4CHRNA7ALDH1A1CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220062252-A1 | CYCLOOXYGENASE INHIBITOR AND CALCIUM CHANNEL ANTAGONIST COMPOSITIONS AND METHODS FOR USE IN UROLOGICAL PROCEDURES | OMEROS CORP (US) | 2022-03-03 | — | — | US | disclosed |