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 | |
|---|---|---|---|---|
| SCHEMBL877401 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL4233990 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL4236575 | 0.83 | — | — | |
| SCHEMBL3471364 | 0.80 | — | — | |
| SCHEMBL4233917 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL4222866 | 0.79 | MEN1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL5176628 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL2933737 | 0.79 | HRH3 (0.32) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL8012760 | 0.79 | ACHE (0.36) | — | |
| Trifluoroacetic Acid SCHEMBL16700666 | 0.79 | NPC1 (0.30) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180170950-A1 | PROCESS FOR SEPARATING ALUMINUM CHLORIDE FROM SILANES | WACKER CHEMIE AG (DE) | 2018-06-21 | — | — | US | claimed |
| WO-2009102419-A2 | ALUMINUM RECOVERY PROCESS | THE UNIVERSITY OF ALABAMA (US) | 2009-08-20 | — | — | WO | claimed |
| CN-101230041-B | Process and system of preparing ultra pure ionic liquids | ACCELERGY SHANGHAI R & D CT CO | 2013-04-17 | — | — | CN | disclosed |
| WO-2009131692-A1 | SUBSTRATES FOR DELIVERY OF PHYSIOLOGICALLY ACTIVE AGENTS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) | 2009-10-29 | — | — | WO | disclosed |
| WO-2009102419-A2 | ALUMINUM RECOVERY PROCESS | THE UNIVERSITY OF ALABAMA (US) | 2009-08-20 | — | — | WO | disclosed |
| CN-101230041-A | Process and system of preparing ultra pure ionic liquids | ACCELERGY SHANGHAI R & D CT CO (CN) | 2008-07-30 | — | — | CN | disclosed |
| WO-2008043309-A1 | PROCESS AND SYSTEM OF PREPARING ULTRA PURE IONIC LIQUIDS | ACCELERGY SHANGHAI R & D CENTER CO., LTD. (CN) | 2008-04-17 | — | — | WO | disclosed |
| WO-2000037400-A1 | HALOGENATION IN IONIC LIQUIDS | INEOS CHLOR LIMITED (GB) | 2000-06-29 | — | — | WO | disclosed |