Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 5/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.39 |
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.35 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL28106928 | 0.70 | ALDH1A1 (0.43) | CHRNB2CHRNA4 | |
| SCHEMBL1605130 | 0.68 | CHRNB2 (0.41) | CHRNB2CHRNA4 | |
| SCHEMBL9267583 | 0.66 | SMYD3 (0.36) | SMYD3 | |
| SCHEMBL27864833 | 0.66 | SMYD3 (0.36) | SMYD3 | |
| SCHEMBL19002455 | 0.66 | SMYD3 (0.36) | SMYD3 | |
| SCHEMBL1606063 | 0.66 | HTT (0.43) | CHRNB2CHRNA4 | |
| SCHEMBL28702771 | 0.65 | SMYD3 (0.38) | SMYD3 | |
| Hydrochloric Acid SCHEMBL28784812 | 0.65 | SMYD3 (0.36) | SMYD3 | |
| Hydrochloric Acid SCHEMBL27770709 | 0.65 | SMYD3 (0.36) | SMYD3 | |
| SCHEMBL1605236 | 0.64 | EPAS1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104193725-B | Organic compound | 诺华股份有限公司 | 2016-11-16 | — | — | CN | disclosed |