Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.35 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.35 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30620797 | 1.00 | CHRNB2 (0.39) | CHRNB2CHRNA4CHRNB4CHRNA3HTR6 | |
| Hydrochloric Acid SCHEMBL31481621 | 0.99 | CHRNB2 (0.39) | CHRNB2CHRNA4CHRNB4CHRNA3HTR6 | |
| SCHEMBL30620799 | 0.94 | CHRNB2 (0.39) | CHRNB2CHRNA4CHRNB4CHRNA3HTR6 | |
| Fumaric Acid SCHEMBL31647335 | 0.93 | CHRNB2 (0.39) | CHRNB2CHRNA4CHRNB4CHRNA3HTR6 | |
| SCHEMBL28059862 | 0.89 | NAMPT (0.41) | CHRNB2CHRNA4CHRNB4CHRNA3GAA | |
| SCHEMBL29601544 | 0.86 | CHRNB2 (0.39) | CHRNB2CHRNA4CHRNB4CHRNA3HTR6 | |
| SCHEMBL29601011 | 0.86 | CHRNB2 (0.39) | CHRNB2CHRNA4CHRNB4CHRNA3HTR6 | |
| SCHEMBL29140304 | 0.86 | CHRNB2 (0.39) | CHRNB2CHRNA4CHRNB4CHRNA3HTR6 | |
| SCHEMBL30620798 | 0.86 | CHRNB2 (0.41) | CHRNB2CHRNA4CHRNB4CHRNA3HTR6 | |
| SCHEMBL30789010 | 0.86 | CHRNB2 (0.39) | CHRNB2CHRNA4CHRNB4CHRNA3HTR6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113214223-B | Preparation method of Voranolan fumarate impurity | 南京海纳医药科技股份有限公司 | 2022-04-05 | — | — | CN | disclosed |
| CN-113214223-A | Preparation method of Voranolan fumarate impurity | 南京海纳医药科技股份有限公司 | 2021-08-06 | — | — | CN | disclosed |