Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 8/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 7/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.40 |
| ▸ | CHRNA2 | Q15822 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29263693 | 1.00 | CHRNB2 (0.40) | CHRNB2CHRNA3CHRNA4CHRNB4CHRNA2 | |
| SCHEMBL5240290 | 0.87 | GRM5 (0.41) | CHRNB2CHRNA4KDM4EGRM5TLR7 | |
| Biphenyl SCHEMBL27555363 | 0.85 | CYP1A2 (0.37) | CHRNB2CHRNA3CHRNA4CHRNB4KDM4E | |
| SCHEMBL17567286 | 0.77 | GRM5 (0.45) | CHRNB2CHRNA4KDM4ECYP2C9CYP2C19 | |
| SCHEMBL101818 | 0.76 | CYP1A2 (0.50) | KDM4EALDH1A1CYP1A2CYP3A4MAPT | |
| SCHEMBL31645197 | 0.74 | TLR7 (0.38) | CHRNB2CHRNA3CHRNA4CHRNB4CHRNA2 | |
| SCHEMBL9741198 | 0.74 | GRM5 (0.33) | GRM5 | |
| SCHEMBL15870932 | 0.72 | GRM5 (0.59) | KDM4EGRM5POLB | |
| SCHEMBL31286309 | 0.72 | GRM5 (0.59) | KDM4EGRM5POLB | |
| SCHEMBL28148504 | 0.72 | GRM5 (0.47) | CHRNB2CHRNA4KDM4EALDH1A1CYP1A2 |
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-118255685-A | Tricyclic compound, pharmaceutical composition and application thereof | 珂阑(上海)医药科技有限公司 | 2024-06-28 | — | — | CN | disclosed |