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 SCHEMBL7193652 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL1135120 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL4457966 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL616016 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL7545529 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL7926934 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL3742536 | 0.75 | — | — | |
| Bromide SCHEMBL7889947 | 0.74 | — | — | |
| SCHEMBL7937456 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL3733825 | 0.71 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0841349-B1 | Catalyst for alpha-olefin polymerization and production of poly-alpha-olefin therewith | MITSUI CHEMICALS INC (JP) | 2002-06-12 | — | — | EP | disclosed |
| US-6121394-A | Metallocene-catalyzed olefin polymerization in the absence of aluminoxane | MITSUI CHEMICALS, INC. (JP) | 2000-09-19 | — | — | US | disclosed |
| EP-0500944-B1 | CATALYST FOR ALPHA-OLEFIN POLYMERIZATION AND PRODUCTION OF POLY-ALPHA-OLEFIN THEREWITH | MITSUI CHEMICALS INC (JP) | 1998-10-07 | — | — | EP | disclosed |
| EP-0841349-A2 | Catalyst for alpha-olefin polymerization and production of poly-alpha-olefin therewith | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1998-05-13 | — | — | EP | disclosed |
| EP-0500944-A1 | CATALYST FOR $g(a)-OLEFIN POLYMERIZATION AND PRODUCTION OF POLY-$g(a)-OLEFIN THEREWITH | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1992-09-02 | — | — | EP | disclosed |