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 SCHEMBL191166 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL2369365 | 1.00 | — | — | |
| Water SCHEMBL234686 | 0.89 | — | — | |
| Water SCHEMBL8143385 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL4622198 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL7559882 | 0.89 | — | — | |
| Water SCHEMBL9447329 | 0.89 | — | — | |
| Water SCHEMBL7523099 | 0.89 | — | — | |
| Water SCHEMBL9116135 | 0.89 | — | — | |
| Water SCHEMBL248737 | 0.89 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4498402-A | FLOWING MIXTURE OF FLUE GAS AND CONDITIONER THROUGH BOILER | MACEY, CHRISTOPHER J. | 1985-02-12 | — | — | US | disclosed |