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 SCHEMBL967771 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL7524705 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL7525201 | 0.71 | — | — | |
| SCHEMBL7529596 | 0.70 | — | — | |
| SCHEMBL7520426 | 0.69 | — | — | |
| SCHEMBL7525889 | 0.68 | — | — | |
| Octane SCHEMBL28018307 | 0.66 | TSHR (0.38) | — | |
| Zinc Ion SCHEMBL868059 | 0.66 | TSHR (0.57) | — | |
| Lithium Ion SCHEMBL906568 | 0.66 | TSHR (0.57) | — | |
| Lithium Ion SCHEMBL4303048 | 0.66 | TSHR (0.57) | — |
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-20020077433-A1 | Catalyst system for the polymerization of dienes | BAYER AKTIENGESELLSCHAFT (DE) | 2002-06-20 | — | — | US | disclosed |