Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 5/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 2/20 | 0.36 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.36 |
| ▸ | CHRNB3 | Q05901 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28875444 | 1.00 | CHRNB4 (0.42) | CHRNB4CHRNA3KDM4ECYP2D6CYP2C19 | |
| SCHEMBL15567228 | 0.97 | ALDH1A1 (0.41) | CHRNB4CHRNA3KDM4ECYP2D6CYP2C19 | |
| SCHEMBL6205627 | 0.86 | CHRNB4 (0.57) | CHRNB4CHRNA3CHRNB1CHRNB2CHRNB3 | |
| SCHEMBL5240331 | 0.86 | CHRNB4 (0.57) | CHRNB4CHRNA3CHRNB1CHRNB2CHRNB3 | |
| SCHEMBL28311169 | 0.84 | FAAH (0.43) | CHRNB4CHRNA3KDM4ECYP2D6CYP2C19 | |
| SCHEMBL618400 | 0.84 | KDM4E (0.42) | CHRNB4CHRNA3KDM4ECYP2D6CYP2C19 | |
| SCHEMBL618399 | 0.84 | KDM4E (0.42) | CHRNB4CHRNA3KDM4ECYP2D6CYP2C19 | |
| SCHEMBL28460946 | 0.84 | CHRNB4 (0.42) | CHRNB4CHRNA3KDM4ECYP2D6CYP2C19 | |
| SCHEMBL28461072 | 0.84 | CHRNB4 (0.42) | CHRNB4CHRNA3KDM4ECYP2D6CYP2C19 | |
| SCHEMBL28311231 | 0.83 | CHRNB4 (0.42) | CHRNB4CHRNA3KDM4ECYP2D6CYP2C19 |
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-110115365-A | The adjusting that actinism receptor and relative ligand are carried out | 西诺米克斯公司 | 2019-08-13 | — | — | CN | disclosed |