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 SCHEMBL27498753 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL200261 | 1.00 | — | — | |
| SCHEMBL30665630 | 0.94 | — | — | |
| SCHEMBL30756648 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL4002029 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL21351719 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL22041939 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL21300485 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL3163696 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL9780549 | 0.88 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1446224-B1 | AROMATIC COMPOUNDS CONTAINING NITROGEN AND P-FUNCTIONALIZED AMINES, THE PRODUCTION THEREOF AND THEIR USE IN CATALYTIC REACTIONS | DEGUSSA (DE) | 2006-01-25 | — | — | EP | disclosed |
| EP-1446224-A2 | AROMATIC COMPOUNDS CONTAINING NITROGEN AND P-FUNCTIONALIZED AMINES, THE PRODUCTION THEREOF AND THEIR USE IN CATALYTIC REACTIONS | Degussa AG (DE) | 2004-08-18 | — | — | EP | disclosed |
| WO-2003043735-A2 | AROMATIC COMPOUNDS CONTAINING NITROGEN AND P-FUNCTIONALIZED AMINES, THE PRODUCTION THEREOF AND THEIR USE IN CATALYTIC REACTIONS | DEGUSSA AG (DE) | 2003-05-30 | — | — | WO | disclosed |