Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL23168321 | 0.79 | CYP2C19 (0.41) | CYP2D6CYP2C19 | |
| SCHEMBL20652724 | 0.75 | — | — | |
| SCHEMBL21118708 | 0.74 | TP53 (0.34) | TP53TSHR | |
| SCHEMBL15562350 | 0.73 | CYP2D6 (0.32) | CYP2D6CYP2C19TSHR | |
| SCHEMBL29059253 | 0.73 | CYP2D6 (0.32) | CYP2D6CYP2C19TSHR | |
| SCHEMBL29130087 | 0.73 | CYP2D6 (0.32) | CYP2D6CYP2C19TSHR | |
| SCHEMBL17709667 | 0.73 | MMP8 (0.33) | CYP2D6CYP2C19 | |
| SCHEMBL28908979 | 0.72 | CYP2D6 (0.31) | CYP2D6CYP2C19 | |
| SCHEMBL29050625 | 0.72 | ALDH1A1 (0.32) | CYP2C19 | |
| SCHEMBL18780017 | 0.71 | TP53 (0.32) | TP53TSHR |
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-116601158-A | Modulators of cystic fibrosis transmembrane conductance regulator | 弗特克斯药品有限公司 | 2023-08-15 | — | — | CN | disclosed |