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 SCHEMBL5588000 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL14954197 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL14954210 | 0.80 | — | — | |
| SCHEMBL30883381 | 0.78 | — | — | |
| SCHEMBL93744 | 0.78 | — | — | |
| SCHEMBL6244671 | 0.78 | — | — | |
| SCHEMBL11602107 | 0.78 | — | — | |
| SCHEMBL29663 | 0.78 | — | — | |
| SCHEMBL3930260 | 0.78 | — | — | |
| SCHEMBL29664 | 0.78 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7247687-B2 | Late transition metal catalysts for olefin polymerization and oligomerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-07-24 | — | — | US | disclosed |
| EP-1521758-B1 | LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION | EXXONMOBIL CHEM PATENTS INC (US) | 2006-05-24 | — | — | EP | disclosed |
| US-20060047094-A1 | Late transition metal catalysts for olefin polymerization and oligomerization | EXXONMOBIL CHEMICAL PATENTS INC. | 2006-03-02 | — | — | US | disclosed |
| EP-1521758-A1 | LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION | Exxonmobil Chemical Patents Inc. (US) | 2005-04-13 | — | — | EP | disclosed |
| WO-2004007509-A1 | LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2004-01-22 | — | — | WO | disclosed |
| US-4556719-A | COMPLEX OF MAGNESIUM, TRANSITION METAL, SALT, AND LIGAND IN PRESENCE OF CATALYTIC ANTHRACENE | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 1985-12-03 | — | — | US | disclosed |
| US-4469638-A | CATALYSTS FOR REACTION OF NITRILES WITH ACETYLENE TO FORM PYRIDINES | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 1984-09-04 | — | — | US | disclosed |