Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
The experimentally established mechanism targets of Xenytropium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 8/20 | 0.69 |
| ▸ | CHRM5 known ✓ | P08912 | 6/20 | 0.66 |
| ▸ | CHRM1 known ✓ | P11229 | 6/20 | 0.66 |
| ▸ | CHRM3 known ✓ | P20309 | 5/20 | 0.66 |
| ▸ | CHRM4 known ✓ | P08173 | 4/20 | 0.66 |
| ▸ | BLM | P54132 | 4/20 | 0.71 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.68 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.66 |
| ▸ | TSHR | P16473 | 2/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Xenytropium SCHEMBL24707 | 1.00 | BLM (0.71) | BLMCHRM2PABPC1CYP2C19CHRM5 | |
| Xenytropium SCHEMBL30428452 | 0.99 | CHRM2 (0.71) | BLMCHRM2PABPC1CYP2C19CHRM5 | |
| Xenytropium SCHEMBL29361010 | 0.99 | CHRM2 (0.71) | BLMCHRM2PABPC1CYP2C19CHRM5 | |
| Bromide SCHEMBL29840597 | 0.94 | BLM (0.77) | BLMCHRM2PABPC1CYP2C19CHRM5 | |
| Butropium SCHEMBL1650524 | 0.87 | BLM (0.64) | BLMCHRM2PABPC1CYP2C19CHRM5 | |
| Butropium SCHEMBL26023 | 0.87 | BLM (0.64) | BLMCHRM2PABPC1CYP2C19CHRM5 | |
| Butropium SCHEMBL30185784 | 0.87 | BLM (0.64) | BLMCHRM2PABPC1CYP2C19CHRM5 | |
| Butropium SCHEMBL11561521 | 0.87 | BLM (0.64) | BLMCHRM2PABPC1CYP2C19CHRM5 | |
| Fentonium SCHEMBL30186606 | 0.86 | BLM (0.69) | BLMCHRM2PABPC1CYP2C19CHRM5 | |
| Fentonium SCHEMBL24583 | 0.86 | BLM (0.69) | BLMCHRM2PABPC1CYP2C19CHRM5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115034225-A | Word processing method and device applied to medical field, electronic equipment and medium | 神州医疗科技股份有限公司 | 2022-09-09 | — | — | CN | disclosed |
| CN-114996466-A | Method and system for establishing medical standard mapping model and using method | 神州医疗科技股份有限公司 | 2022-09-02 | — | — | CN | disclosed |
| CN-110812442-B | Preparation method and application of five-ginseng-astragalus oral solution | 湖北威仕生物药业股份有限公司 | 2022-02-08 | — | — | CN | disclosed |