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 | |
|---|---|---|---|---|
| SCHEMBL314258 | 0.89 | — | — | |
| Bromide SCHEMBL2362273 | 0.80 | — | — | |
| Zinc Ion SCHEMBL8164666 | 0.80 | CA1 (0.50) | — | |
| Hydrochloric Acid SCHEMBL11659484 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL5731259 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL9808348 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL7555903 | 0.73 | — | — | |
| Potassium Ion SCHEMBL1332472 | 0.67 | — | — | |
| SCHEMBL3799398 | 0.67 | — | — | |
| SCHEMBL352283 | 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-6335303-B1 | EFFECTIVE IN POLYMERIZATION OF ALPHA OLEFINS TO HIGH MOLECULAR WEIGHT POLYMERS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2002-01-01 | — | — | US | disclosed |
| WO-1998045039-A1 | POLYMERIZATION CATALYSTS CONTAINING ELECTRON-WITHDRAWING AMIDE LIGANDS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1998-10-15 | — | — | WO | disclosed |