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 SCHEMBL8777397 | 0.74 | GRIK1 (0.31) | — | |
| SCHEMBL4701356 | 0.71 | CYP2C19 (0.34) | — | |
| SCHEMBL9657673 | 0.71 | CYP2C19 (0.31) | — | |
| Hydrochloric Acid SCHEMBL9627054 | 0.70 | — | — | |
| SCHEMBL1551956 | 0.69 | CHRM2 (0.31) | — | |
| SCHEMBL28245652 | 0.69 | CHRM2 (0.31) | — | |
| Hydrochloric Acid SCHEMBL28421235 | 0.68 | CYP2C19 (0.44) | — | |
| SCHEMBL11126349 | 0.67 | CHRM2 (0.33) | — | |
| SCHEMBL18612376 | 0.67 | RNPEP (0.32) | — | |
| SCHEMBL18035806 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7652180-B2 | Process for preparing alkyl chlorides | DEGUSSA AG (DE) | 2010-01-26 | — | — | US | disclosed |
| US-20060205987-A1 | Process for preparing alkyl chlorides | DEGUSSA AG (DE) | 2006-09-14 | — | — | US | disclosed |