Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 2/20 | 0.58 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.58 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.57 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.56 |
| ▸ | PDE4A | P27815 | 2/20 | 0.56 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.56 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | CA7 | P43166 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28324572 | 1.00 | CHRNB4 (0.58) | CHRNB4CHRNA3RIPK1PDE4BPDE4A | |
| SCHEMBL791939 | 0.88 | TDP1 (0.59) | CHRNB4CHRNA3RIPK1PDE4BPDE4A | |
| Hydrochloric Acid SCHEMBL1474990 | 0.86 | TDP1 (0.62) | CHRNB4CHRNA3RIPK1PDE4BPDE4A | |
| SCHEMBL2299760 | 0.83 | ADRA2C (0.57) | CHRNB4CHRNA3RIPK1PDE4BPDE4A | |
| SCHEMBL2587027 | 0.82 | SMN1; SMN2 (0.57) | CHRNB4CHRNA3RIPK1PDE4BPDE4A | |
| SCHEMBL16872415 | 0.82 | HTR2A (0.54) | RIPK1PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL17111303 | 0.82 | HTR2A (0.54) | PDE4BPDE4APDE4CPDE4DHTR2C | |
| SCHEMBL1477493 | 0.81 | ADRA2C (0.59) | CHRNB4CHRNA3ADRA2CHTR2CTDP1 | |
| SCHEMBL791389 | 0.80 | CYP2C9 (0.53) | CHRNB4CHRNA3PDE4BPDE4APDE4C | |
| SCHEMBL256797 | 0.80 | ALDH1A1 (0.65) | RIPK1ALDH1A1HTR2CSMN1; SMN2TDP1 |
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-115197191-A | Novel traditional Chinese medicine flavone derivative and preparation method and application thereof | 中国海洋大学 | 2022-10-18 | — | — | CN | disclosed |