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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL6659991 | 0.96 | ALDH1A1 (0.33) | ALDH1A1TSHRCYP1A2CYP2C19 | |
| SCHEMBL6657779 | 0.95 | ALDH1A1 (0.32) | ALDH1A1TSHRCYP1A2CYP2C19 | |
| SCHEMBL6658153 | 0.95 | ALDH1A1 (0.32) | ALDH1A1TSHRCYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL6662243 | 0.76 | — | — | |
| SCHEMBL28150718 | 0.74 | OPRM1 (0.35) | — | |
| SCHEMBL6657784 | 0.72 | SLC6A5 (0.30) | — | |
| SCHEMBL6061606 | 0.68 | LMNA (0.32) | — | |
| SCHEMBL5828136 | 0.65 | LMNA (0.31) | ALDH1A1TSHRCYP1A2 | |
| SCHEMBL5827526 | 0.65 | LMNA (0.31) | ALDH1A1TSHRCYP1A2 | |
| SCHEMBL6656283 | 0.64 | LMNA (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1160267-B1 | CATALYST FOR OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, METHOD OF OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, AND POLY(OXYFLUOROPHENYLENE) DERIVATIVE | JAPAN SCIENCE & TECH CORP (JP) | 2004-08-04 | — | — | EP | disclosed |