Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 4/20 | 0.31 |
| ▸ | CHRM1 known ✓ | P11229 | 2/20 | 0.31 |
| ▸ | CHRM3 known ✓ | P20309 | 3/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28201730 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL28201729 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL7744956 | 0.73 | CHRM2 (0.31) | CHRM2CHRM5CHRM1TSHRMAPK1 | |
| Bromide SCHEMBL25299851 | 0.71 | ALDH1A1 (0.31) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL475264 | 0.68 | CHRM2 (0.32) | CHRM2CHRM5CHRM1TSHRMAPK1 | |
| SCHEMBL51487 | 0.66 | — | — | |
| SCHEMBL13773188 | 0.66 | — | — | |
| SCHEMBL13773198 | 0.66 | — | — | |
| SCHEMBL27533253 | 0.66 | ALDH1A1 (0.38) | CHRM2CHRM5CHRM1TSHRMAPK1 | |
| SCHEMBL52033 | 0.66 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104784685-B | The preparation method of the hydroxypropyl dimethyl ethyl ammonium chloride chitosan/carboxymethyl chitosan NDV nanoparticles of N 2 | 黑龙江大学 | 2018-03-13 | — | — | CN | claimed |
| CN-104784685-A | Preparation method for N-2-hydroxypropyldimethylethyl ammonium chloride chitosan/carboxymethyl chitosan Newcastle disease virus nanoparticles | UNIV HEILONGJIANG | 2015-07-22 | — | — | CN | claimed |
| CN-104784685-B | The preparation method of the hydroxypropyl dimethyl ethyl ammonium chloride chitosan/carboxymethyl chitosan NDV nanoparticles of N 2 | 黑龙江大学 | 2018-03-13 | — | — | CN | disclosed |
| CN-104784685-A | Preparation method for N-2-hydroxypropyldimethylethyl ammonium chloride chitosan/carboxymethyl chitosan Newcastle disease virus nanoparticles | UNIV HEILONGJIANG | 2015-07-22 | — | — | CN | disclosed |