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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL10875611 | 1.00 | — | — | |
| Fluoride Ion SCHEMBL27577131 | 0.92 | — | — | |
| SCHEMBL8665680 | 0.86 | ALDH1A1 (0.33) | — | |
| SCHEMBL8668455 | 0.81 | ALDH1A1 (0.30) | — | |
| Butadiene SCHEMBL8665431 | 0.76 | — | — | |
| SCHEMBL110025 | 0.73 | — | — | |
| SCHEMBL425874 | 0.73 | — | — | |
| SCHEMBL5328842 | 0.73 | — | — | |
| SCHEMBL27683 | 0.73 | — | — | |
| SCHEMBL1760717 | 0.73 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105264152-B | Build isolated material | 金伯利-克拉克环球有限公司 | 2018-09-25 | — | — | CN | disclosed |
| EP-0416928-A2 | New carrier catalyst for the polymerization of ethylene | Borealis Holding A/S (DK) | 1991-03-13 | — | — | EP | disclosed |
| WO-1988004673-A1 | ETHYLENE COPOLYMERS | EXXON CHEMICAL PATENTS, INC. (US) | 1988-06-30 | — | — | WO | disclosed |
| EP-0108847-B1 | PRODUCTION OF ACETIC ACID, PROPIONIC ACID AND THEIR ESTERS | TEXACO DEVELOPMENT CORPORATION (US) | 1986-06-18 | — | — | EP | disclosed |
| EP-0108847-A1 | Production of acetic acid, propionic acid and their esters | TEXACO DEVELOPMENT CORPORATION (US) | 1984-05-23 | — | — | EP | disclosed |